DOI: 10.1016/j.cattod.2018.10.071. Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches

Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches

10.1016/j.cattod.2018.10.071

Crossref journal-article

Elsevier BV

Catalysis Today (78)

Bibliography

Guda, A. A., Guda, S. A., Lomachenko, K. A., Soldatov, M. A., Pankin, I. A., Soldatov, A. V., Braglia, L., Bugaev, A. L., Martini, A., Signorile, M., Groppo, E., Piovano, A., Borfecchia, E., & Lamberti, C. (2019). Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches. Catalysis Today, 336, 3â21.

Authors 14

Alexander A. Guda (first)
Sergey A. Guda (additional)
Kirill A. Lomachenko (additional)
Mikhail A. Soldatov (additional)
Ilia A. Pankin (additional)
Alexander V. Soldatov (additional)
Luca Braglia (additional)
Aram L. Bugaev (additional)
Andrea Martini (additional)
Matteo Signorile (additional)
Elena Groppo (additional)
Alessandro Piovano (additional)
Elisa Borfecchia (additional)
Carlo Lamberti (additional)

References 391 Referenced 88

{'year': '2016', 'series-title': 'X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications', 'author': 'van Bokhoven', 'key': '10.1016/j.cattod.2018.10.071_bib0005'} / X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications by van Bokhoven (2016)
10.1103/PhysRev.16.202 / Phys. Rev. by Fricke (1920)
10.1007/BF01356225 / Z. Phys. by Hertz (1920)
10.1007/BF01327991 / Z. Phys. by Lindh (1921)
10.1007/BF02980572 / Z. Phys. by Lindh (1925)
10.1007/BF01336770 / Z. Phys. by Lindh (1930)
10.1007/BF01327511 / Z. Phys. by Coster (1924)
10.1007/BF01339580 / Z. Phys. by Coster (1931)
10.1007/BF01342373 / Z. Phys. by Coster (1932)
10.1103/PhysRev.26.525 / Phys. Rev. by Chamberlain (1925)
10.1007/BF01341219 / Z. Phys. by Ray (1929)
10.1080/14786441208564948 / Philos. Mag. by Yost (1929)
10.1103/PhysRev.36.648 / Phys. Rev. by Kievit (1930)
10.1103/PhysRev.37.715 / Phys. Rev. by Hanawalt (1931)
10.1007/BF01339579 / Z. Phys. by Hanawalt (1931)
10.1088/0959-5309/46/2/304 / Proc. Phys. Soc. by Rao (1934)
10.1103/RevModPhys.35.1012 / Rev. Mod. Phys. by Azaroff (1963)
10.1103/PhysRevLett.27.1204 / Phys. Rev. Lett. by Sayers (1971)
10.1103/PhysRevB.11.4825 / Phys. Rev. B by Lytle (1975)
10.1103/PhysRevB.11.4836 / Phys. Rev. B by Stern (1975)
10.1107/S0909049596005651 / J. Synchrot. Radiat. by Binsted (1996)
10.1103/RevModPhys.72.621 / Rev. Mod. Phys. by Rehr (2000)
{'key': '10.1016/j.cattod.2018.10.071_bib0115', 'series-title': 'X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications', 'first-page': '51', 'article-title': 'Real-space multiple-scattering theory of X-ray spectra', 'author': 'Kas', 'year': '2016'} / X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications / Real-space multiple-scattering theory of X-ray spectra by Kas (2016)
10.1016/0038-1098(91)90194-Z / Solid State Commun. by Filipponi (1991)
10.1103/PhysRevB.52.15122 / Phys. Rev. B by Filipponi (1995)
10.1103/PhysRevB.52.15135 / Phys. Rev. B by Filipponi (1995)
{'key': '10.1016/j.cattod.2018.10.071_bib0135', 'series-title': 'X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications', 'first-page': '3', 'article-title': 'Introduction: historical perspective on XAS', 'author': 'Lamberti', 'year': '2016'} / X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications / Introduction: historical perspective on XAS by Lamberti (2016)
10.1016/0378-5963(80)90024-0 / Appl. Surf. Sci. by Bianconi (1980)
10.1016/S0360-0564(08)60602-1 / Adv. Catal. by Van Nordsthand (1960)
10.1016/0038-1098(93)90123-5 / Solid State Commun. by Li (1993)
10.1007/BF00824045 / Catal. Lett. by Bordiga (1994)
10.1006/jcat.1996.0048 / J. Catal. by Bordiga (1996)
10.1103/PhysRevB.43.6885 / Phys. Rev. B by Bianconi (1991)
10.1103/PhysRevB.46.5997 / Phys. Rev. B by Tyson (1992)
10.1039/B920681G / Chem. Commun. by Gianolio (2010)
10.1021/jp305756k / J. Phys. Chem. C by Borfecchia (2012)
10.1021/acs.jctc.5b00327 / J. Chem. Theory Comput. by Guda (2015)
10.1088/1742-6596/712/1/012004 / J. Phys. Conf. Ser. by Guda (2016)
10.1016/j.cattod.2016.02.039 / Catal. Today by Braglia (2017)
10.1039/C7FD00024C / Faraday Discuss. by Braglia (2017)
10.1021/jacs.7b02161 / J. Am. Chem. Soc. by Tulchinsky (2017)
10.1016/j.jallcom.2017.11.062 / J. Alloys. Compd. by Pankin (2018)
10.1021/acs.jpcc.7b12797 / J. Phys. Chem. C by Soldatov (2018)
10.1107/S0909049502017247 / J. Synchrot. Radiat. by Natoli (2003)
10.1016/j.ccr.2004.02.014 / Coord. Chem. Rev. by Rehr (2005)
10.1088/0022-3727/46/42/423001 / J. Phys. D-Appl. Phys. by Mino (2013)
10.1016/j.ccr.2014.03.027 / Coord. Chem. Rev. by Garino (2014)
{'key': '10.1016/j.cattod.2018.10.071_bib0240', 'series-title': 'X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications', 'first-page': '73', 'article-title': 'Theory of X-ray absorption near edge structure', 'author': 'Joly', 'year': '2016'} / X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications / Theory of X-ray absorption near edge structure by Joly (2016)
10.1039/f19888402987 / J. Chem. Soc.-Faraday Trans. I by Tanaka (1988)
10.1021/j100027a034 / J. Phys. Chem. by Hu (1995)
10.1039/FT9959103245 / J. Chem. Soc.-Faraday Trans. by Weckhuysen (1995)
10.1016/S0009-2614(97)00297-2 / Chem. Phys. Lett. by Lamberti (1997)
10.1039/a708778k / J. Chem. Soc.-Faraday Trans. by Lamberti (1998)
10.1063/1.1319318 / J. Chem. Phys. by Bolis (2000)
10.1002/1521-3773(20000616)39:12<2138::AID-ANIE2138>3.0.CO;2-9 / Angew. Chem.-Int. Edit. by Lamberti (2000)
10.1021/jp993224g / J. Phys. Chem. B by Rodriguez (2000)
10.1006/jcat.2001.3257 / J. Catal. by Sun (2001)
10.1063/1.1432688 / J. Chem. Phys. by Ankudinov (2002)
10.1081/CR-120001459 / Catal. Rev.-Sci. Eng. by Fernandez-Garcia (2002)
10.1039/b207159b / Chem. Commun. by Izumi (2002)
10.1002/1521-3773(20020703)41:13<2341::AID-ANIE2341>3.0.CO;2-P / Angew. Chem.-Int. Edit. by Lamberti (2002)
10.1016/S0009-2614(02)01183-1 / Chem. Phys. Lett. by Prestipino (2002)
10.1021/jp0223051 / J. Phys. Chem. B by Bazin (2003)
10.1039/B305810G / Phys. Chem. Chem. Phys. by Lamberti (2003)
10.1021/ja048225n / J. Am. Chem. Soc. by Tromp (2005)
10.1021/ja0689233 / J. Am. Chem. Soc. by Bus (2007)
10.1016/j.apcata.2007.07.027 / Appl. Catal. A-Gen. by Jacobs (2007)
10.1002/anie.200802815 / Angew. Chem.-Int. Edit. by Groppo (2008)
10.1016/j.jcat.2009.09.018 / J. Catal. by Oyama (2009)
10.1063/1.3125940 / J. Chem. Phys. by Smolentsev (2009)
10.1039/b925910b / Phys. Chem. Chem. Phys. by Chen (2010)
10.1039/b926502n / Phys. Chem. Chem. Phys. by Muddada (2010)
10.1039/b927120c / Phys. Chem. Chem. Phys. by Ramaker (2010)
10.1016/j.cattod.2009.10.010 / Catal. Today by Ronning (2010)
10.1016/j.jcat.2010.12.016 / J. Catal. by Liu (2011)
10.1021/cs300445y / ACS Catal. by Gaskell (2012)
10.1016/j.nimb.2011.08.004 / Nucl. Instrum. Methods Phys. Res. Sect. B-Beam Interact. Mater. Atoms by Gianolio (2012)
10.1021/ja310111p / J. Am. Chem. Soc. by He (2013)
10.1002/anie.201300538 / Angew. Chem.-Int. Edit. by Tougerti (2013)
10.1021/cr2000898 / Chem. Rev. by Bordiga (2013)
10.1021/ja5062505 / J. Am. Chem. Soc. by Boubnov (2014)
10.1021/jz500241m / J. Phys. Chem. Lett. by Giordanino (2014)
10.1002/anie.201403585 / Angew. Chem.-Int. Edit. by Gorczyca (2014)
10.1021/cs500148e / ACS Catal. by Yao (2014)
10.1002/anie.201703808 / Angew. Chem.-Int. Edit. by Andersen (2017)
10.1021/acscatal.7b02946 / ACS Catal. by Stubbs (2018)
10.1103/PhysRevLett.67.2850 / Phys. Rev. Lett. by Hamalainen (1991)
10.1016/j.ccr.2004.04.011 / Coord. Chem. Rev. by Glatzel (2005)
10.1039/c0cs00054j / Chem. Soc. Rev. by Singh (2010)
10.1134/S1063774506060022 / Crystal. Rep. by Aksenov (2006)
{'year': '1950', 'series-title': 'Nuclear Physics', 'author': 'Fermi', 'key': '10.1016/j.cattod.2018.10.071_bib0455'} / Nuclear Physics by Fermi (1950)
{'key': '10.1016/j.cattod.2018.10.071_bib0460', 'series-title': 'Surfaces and Interfaces of Electronic Materials', 'first-page': '552', 'article-title': 'Appendix 6: derivation of Fermi’s golden rule', 'author': 'Brillson', 'year': '2010'} / Surfaces and Interfaces of Electronic Materials / Appendix 6: derivation of Fermi’s golden rule by Brillson (2010)
{'key': '10.1016/j.cattod.2018.10.071_bib0465', 'series-title': 'Characterization of Semiconductor Heterostructures and Nanostructures', 'first-page': '259', 'article-title': 'X-ray absorption fine structure in the study of semiconductor heterostructures and nanostructures', 'author': 'Boscherini', 'year': '2013'} / Characterization of Semiconductor Heterostructures and Nanostructures / X-ray absorption fine structure in the study of semiconductor heterostructures and nanostructures by Boscherini (2013)
10.1016/B978-0-12-805090-3.00007-3 / Stud. Surf. Sci. Catal. by Borfecchia (2017)
{'key': '10.1016/j.cattod.2018.10.071_bib0475', 'first-page': '243', 'volume': '114', 'author': 'Dirac', 'year': '1927', 'journal-title': 'Proc. Roy. Soc. (London) A'} / Proc. Roy. Soc. (London) A by Dirac (1927)
10.1002/open.201300012 / ChemistryOpen by Steinmetz (2013)
10.1021/ja990747t / J. Am. Chem. Soc. by Rosa (1999)
10.1016/S0010-8545(02)00093-0 / Coord. Chem. Rev. by Baerends (2002)
10.1016/S0009-2614(03)00543-8 / Chem. Phys. Lett. by Stener (2003)
10.1021/ja052467l / J. Am. Chem. Soc. by Nazeeruddin (2005)
10.1002/qua.22041 / Int. J. Quantum Chem. by Luzanov (2010)
10.1021/om100734y / Organometallics by Salassa (2010)
10.1002/chem.201001996 / Chem.-Eur. J. by Jaszewski (2011)
10.1039/c3dt32865a / Dalton Trans. by Borfecchia (2013)
10.1088/0953-8984/21/10/104207 / J. Phys. Condens. Matter by de Groot (2009)
10.1016/j.ccr.2004.03.018 / Coord. Chem. Rev. by Groot (2005)
10.1103/PhysRevLett.80.794 / Phys. Rev. Lett. by Shirley (1998)
10.1016/j.elspec.2005.01.191 / J. Electron Spectrosc. Relat. Phenom. by Shirley (2005)
10.1039/b903676h / Phys. Chem. Chem. Phys. by Sagmeister (2009)
10.1103/PhysRevB.83.115106 / Phys. Rev. B by Vinson (2011)
10.1016/j.cpc.2015.08.014 / Comput. Phys. Commun. by Gilmore (2015)
10.1063/1.4896373 / J. Chem. Phys. by Pinjari (2014)
10.1039/C5CP07487H / Phys. Chem. Chem. Phys. by Guo (2016)
10.1088/0953-8984/20/6/064202 / J. Phys.-Condes. Matter by Held (2008)
10.1088/0034-4885/61/3/002 / Rep. Prog. Phys. by Aryasetiawan (1998)
10.1103/PhysRevB.94.035118 / Phys. Rev. B by Nabok (2016)
10.1103/RevModPhys.74.601 / Rev. Mod. Phys. by Onida (2002)
10.1016/j.crhy.2008.08.004 / Comptes Rendus Phys. by Rehr (2009)
10.1103/PhysRevB.63.125120 / Phys. Rev. B by Joly (2001)
10.1107/S0909049502017211 / J. Synchrot. Radiat. by Joly (2003)
{'key': '10.1016/j.cattod.2018.10.071_bib0605', 'first-page': '391', 'volume': '99', 'author': 'Fonseca Guerra', 'year': '1998', 'journal-title': 'Theor. Chem. Acc.'} / Theor. Chem. Acc. by Fonseca Guerra (1998)
10.1088/0953-8984/21/39/395502 / J. Phys.-Condes. Matter by Giannozzi (2009)
10.1524/zkri.220.5.574.65062 / Z. Kristall. by Scandolo (2005)
{'key': '10.1016/j.cattod.2018.10.071_bib0620', 'first-page': '49', 'volume': '32', 'author': 'Giannozzi', 'year': '2009', 'journal-title': 'Nuovo Cimento Soc. Ital. Fis. C-Colloq. Phys.'} / Nuovo Cimento Soc. Ital. Fis. C-Colloq. Phys. by Giannozzi (2009)
10.1016/j.cpc.2017.01.008 / Comput. Phys. Commun. by Barnes (2017)
10.1088/1361-648X/aa8f79 / J. Phys.-Condes. Matter by Giannozzi (2017)
10.1103/PhysRevB.66.195107 / Phys. Rev. B by Taillefumier (2002)
10.1103/PhysRevB.80.075102 / Phys. Rev. B by Gougoussis (2009)
10.1021/acs.inorgchem.6b01704 / Inorg. Chem. by Vollmers (2016)
10.1002/jcc.1056 / J. Comput. Chem. by te Velde (2001)
10.1002/wcms.81 / Rev.-Comput. Mol. Sci. by Neese (2012)
10.1002/wcms.1327 / Rev.-Comput. Mol. Sci. by Neese (2018)
10.1016/j.ccr.2014.02.013 / Coord. Chem. Rev. by Milne (2014)
10.1021/acs.chemrev.8b00156 / Chem. Rev. by Norman (2018)
10.1021/ct5006888 / J. Chem. Theory Comput. by Wenzel (2014)
10.1021/acs.jpcc.6b06883 / J. Phys. Chem. C by Moonshiram (2016)
10.1021/jacs.6b05680 / J. Am. Chem. Soc. by Moonshiram (2016)
10.1039/b926434e / Phys. Chem. Chem. Phys. by Rehr (2010)
10.1002/pssb.2221110202 / Phys. Status Solidi B by Vedrinskii (1982)
10.1002/pssb.2221340122 / Phys. Status Solidi B-Basic Res. by Datsyuk (1986)
{'key': '10.1016/j.cattod.2018.10.071_bib0705', 'series-title': 'Electronic Structure and Physical Properties of Solids: the Users of the LMTO Method', 'first-page': '191', 'article-title': 'Fully relativistic band structure calculations for magnetic solids - formalism and application', 'author': 'Ebert', 'year': '2000'} / Electronic Structure and Physical Properties of Solids: the Users of the LMTO Method / Fully relativistic band structure calculations for magnetic solids - formalism and application by Ebert (2000)
10.1088/0034-4885/74/9/096501 / Rep. Prog. Phys. by Ebert (2011)
10.1103/PhysRevLett.87.155501 / Phys. Rev. Lett. by Della Longa (2001)
10.1107/S0909049500015338 / J. Synchrot. Radiat. by Benfatto (2001)
10.1107/S0909049502018137 / J. Synchrot. Radiat. by Benfatto (2003)
10.1021/ic050703n / Inorg. Chem. by Sarangi (2005)
10.1063/1.2644444 / AIP Conf. Proc. by Hayakawa (2007)
10.1088/1742-6596/190/1/012031 / J. Phys. Conf. Ser. by Benfatto (2009)
{'key': '10.1016/j.cattod.2018.10.071_bib0745', 'series-title': 'Gaussian 09, Revision A.02', 'article-title': 'Gaussian 09', 'author': 'Frisch', 'year': '2016'} / Gaussian 09, Revision A.02 / Gaussian 09 by Frisch (2016)
10.1016/S0010-4655(02)00206-0 / Comput. Phys. Commun. by Schwarz (2002)
10.1016/S0927-0256(03)00112-5 / Comput. Mater. Sci. by Schwarz (2003)
10.1016/S0968-4328(03)00030-1 / Micron by Hebert (2003)
10.1016/S0022-4596(03)00213-5 / J. Solid State Chem. by Schwarz (2003)
10.1016/j.micron.2006.03.010 / Micron by Hebert (2007)
10.1080/00268976.2010.506451 / Mol. Phys. by Schwarz (2010)
10.1016/j.cpc.2011.12.010 / Comput. Phys. Commun. by Pardini (2012)
10.1103/PhysRevB.85.165113 / Phys. Rev. B by Haverkort (2012)
10.1143/JPSJ.63.2788 / J. Phys. Soc. Jpn. by Tanaka (1994)
10.1016/j.micron.2010.06.005 / Micron by Stavitski (2010)
10.1016/S0927-0256(03)00109-5 / Comput. Mater. Sci. by Karlstrom (2003)
10.1002/jcc.21318 / J. Comput. Chem. by Aquilante (2010)
10.1002/wcms.1117 / Rev.-Comput. Mol. Sci. by Aquilante (2013)
10.1002/jcc.24221 / J. Comput. Chem. by Aquilante (2016)
10.1088/0953-8984/26/36/363202 / J. Phys.-Condes. Matter by Gulans (2014)
10.1063/1.1839852 / J. Chem. Phys. by Skylaris (2005)
10.1103/PhysRev.51.846 / Phys. Rev. by Slater (1937)
10.1103/PhysRevB.82.024105 / Phys. Rev. B by Beale (2010)
10.1021/acs.inorgchem.7b01471 / Inorg. Chem. by Gallo (2017)
{'year': '2016', 'series-title': 'Resolving Spectral Mixtures: With Applications From Ultrafast Time-resolved Spectroscopy to Super-resolution Imaging', 'author': 'Ruckebusch', 'key': '10.1016/j.cattod.2018.10.071_bib0845'} / Resolving Spectral Mixtures: With Applications From Ultrafast Time-resolved Spectroscopy to Super-resolution Imaging by Ruckebusch (2016)
10.1016/0169-7439(95)00047-X / Chemometr. Intell. Lab. Syst. by Tauler (1995)
10.1016/j.chemolab.2004.12.007 / Chemometr. Intell. Lab. by Jaumot (2005)
10.1016/j.chemolab.2014.10.003 / Chemometr. Intell. Lab. by Jaumot (2015)
10.1021/j100033a032 / J. Phys. Chem. by Fernandez Garcia (1995)
{'year': '2002', 'series-title': 'Factor Analysis in Chemistry', 'author': 'Malinowski', 'key': '10.1016/j.cattod.2018.10.071_bib0870'} / Factor Analysis in Chemistry by Malinowski (2002)
10.1039/C7CP05185A / Phys. Chem. Chem. Phys. by Braglia (2017)
10.1016/0169-7439(88)80051-0 / Chemometr. Intell. Lab. Syst. by Maeder (1988)
10.1021/ac00014a016 / Anal. Chem. by Windig (1991)
10.1016/j.chemolab.2011.05.009 / Chemometr. Intell. Lab. Syst. by Abdollahi (2011)
10.1021/ac902865h / Anal. Chem. by Conti (2010)
10.1021/acs.jpcc.6b10062 / J. Phys. Chem. C by Caetano (2017)
10.1021/cm401352t / Chem. Mat. by Carvalho (2013)
10.1016/j.cattod.2013.10.077 / Catal. Today by Cassinelli (2014)
10.1016/j.aca.2014.06.050 / Anal. Chim. Acta by Voronov (2014)
10.1021/cs501799p / ACS Catal. by Hong (2015)
10.1021/acs.jpcc.7b03735 / J. Phys. Chem. C by Rochet (2017)
10.1002/cctc.201700319 / ChemCatChem by Passos (2017)
10.1021/jacs.6b11872 / J. Am. Chem. Soc. by Tsakoumis (2017)
10.1039/C7SC02266B / Chem. Sci. by Martini (2017)
10.2138/am-2016-5556 / Am. Mineral. by Dyar (2016)
10.1039/c2ja30149k / J. Anal. At. Spectrom. by Borfecchia (2012)
10.1016/j.cattod.2013.11.002 / Catal. Today by Mino (2014)
10.1103/RevModPhys.90.025007 / Rev. Mod. Phys. by Mino (2018)
{'year': '2009', 'series-title': 'The Elements of Statistical Learning. Data Mining, Inference, and Prediction', 'author': 'Hastie', 'key': '10.1016/j.cattod.2018.10.071_bib0965'} / The Elements of Statistical Learning. Data Mining, Inference, and Prediction by Hastie (2009)
10.1186/1758-2946-5-34 / J. Cheminformatics by Qu (2013)
10.1021/acs.jcim.6b00340 / J. Chem. Inf. Model. by Pereira (2017)
10.1103/PhysRevB.88.054104 / Phys. Rev. B by Bartok (2013)
10.1080/08927022.2016.1274984 / Mol. Simul. by Boes (2017)
10.1038/s41467-017-00839-3 / Nat. Commun. by Brockherde (2017)
10.1038/s41598-017-08455-3 / Sci. Rep. by Kruglov (2017)
10.1038/srep42669 / Sci. Rep. by Hegde (2017)
10.1021/acs.jpclett.8b00170 / J. Phys. Chem. Lett. by Janet (2018)
10.1038/s41524-018-0067-x / npj Comput. Mater. by Zheng (2018)
10.1021/acs.jpclett.7b02364 / J. Phys. Chem. Lett. by Timoshenko (2017)
10.1103/PhysRevE.80.066117 / Phys. Rev. E by Weinstein (2009)
M. Weinstein, F. Meirer, A. Hume, P. Sciau, G. Shaked, R. Hofstetter, E. Persi, A. Mehta, D. Horn, arXiv:1310.2700v2 [physics.data-an], (2013).
{'year': '2014', 'series-title': 'World Polyethylene, Industry Study With Forecast for 2018 & 2023', 'author': 'World Polyethylene', 'key': '10.1016/j.cattod.2018.10.071_bib1030'} / World Polyethylene, Industry Study With Forecast for 2018 & 2023 by World Polyethylene (2014)
10.1016/S0360-0564(08)60258-8 / Adv. Catal. by McDaniel (1985)
10.1021/cr040083s / Chem. Rev. by Groppo (2005)
10.1016/S0360-0564(10)53003-7 / Adv. Catal. by McDaniel (2010)
{'year': '2014', 'series-title': 'Business and Technology of the Global Polyethylene Industry', 'author': 'Nowlin', 'key': '10.1016/j.cattod.2018.10.071_bib1050'} / Business and Technology of the Global Polyethylene Industry by Nowlin (2014)
J.P. Hogan, R.L. Banks, Patent U.S. Patent 2, 825, 721, (1958).
10.1021/cr940044o / Chem. Rev. by Weckhuysen (1996)
10.1016/j.jcat.2004.11.017 / J. Catal. by Groppo (2005)
10.1016/j.jcat.2005.09.013 / J. Catal. by Groppo (2005)
10.1021/cm050043k / Chem. Mater. by Groppo (2005)
10.1039/b604515d / Phys. Chem. Chem. Phys. by Groppo (2006)
10.1021/jp074066t / J. Phys. Chem. C by Agostini (2007)
10.1002/anie.200602593 / Angew. Chem.-Int. Edit. by Nenu (2007)
10.1021/cr100217q / Chem. Rev. by McGuinness (2011)
10.1039/C2CY20559A / Catal. Sci. Technol. by Groppo (2013)
10.1002/anie.201308983 / Angew. Chem.-Int. Edit. by Conley (2014)
10.1073/pnas.1405314111 / Proc. Natl. Acad. Sci. U. S. A. by Delley (2014)
10.1021/acscatal.5b00927 / ACS Catal. by Brown (2015)
10.1007/s10562-014-1394-2 / Catal. Lett. by Chakrabarti (2015)
10.1002/anie.201506718 / Angew. Chem.-Int. Edit. by Cicmil (2015)
10.1073/pnas.1422589112 / Proc. Natl. Acad. Sci. U. S. A. by Peters (2015)
10.1007/s11244-016-0546-6 / Top. Catal. by Chakrabarti (2016)
10.1002/cctc.201600200 / ChemCatChem by Cicmil (2016)
10.1039/C5CY01512J / Catal. Sci. Technol. by Cicmil (2016)
10.1021/jacs.7b02179 / J. Am. Chem. Soc. by Delley (2017)
10.1021/jacs.7b07437 / J. Am. Chem. Soc. by Barzan (2017)
10.1107/S1600577515017786 / J. Synchrot. Radiat. by Mathon (2015)
M. Taramasso, G. Perego, B. Notari, Patent US Patent No. 4410501, (1983).
10.1016/0021-9517(92)90176-I / J. Catal. by Millini (1992)
10.1021/j100066a036 / J. Phys. Chem. by Bordiga (1994)
10.1021/jp981225n / J. Phys. Chem. B by Lamberti (1998)
10.1016/0021-9517(92)90199-R / J. Catal. by Bellussi (1992)
10.1006/jcat.1994.1085 / J. Catal. by Maspero (1994)
10.1006/jcat.1995.1242 / J. Catal. by Kumar (1995)
{'key': '10.1016/j.cattod.2018.10.071_bib1200', 'first-page': '253', 'article-title': 'Microporous crystalline titanium silicates', 'volume': 'Vol 41', 'author': 'Notari', 'year': '1996'} / Microporous crystalline titanium silicates by Notari (1996)
10.1021/ja7100399 / J. Am. Chem. Soc. by Fan (2008)
10.1002/anie.201105678 / Angew. Chem.-Int. Ed. by Chen (2011)
10.1021/acscatal.7b03558 / ACS Catal. by Lu (2018)
10.1021/acs.jpcc.8b01401 / J. Phys. Chem. C by Signorile (2018)
10.1021/la981420t / Langmuir by Bolis (1999)
10.1016/S1387-1811(99)00016-5 / Microporous Mesoporous Mater. by Bolis (1999)
10.1007/BF00808327 / Catal. Lett. by Davis (1995)
10.1039/b005780k / Phys. Chem. Chem. Phys. by Gleeson (2000)
10.1021/ja010607v / J. Am. Chem. Soc. by Ricchiardi (2001)
10.1021/jp026106t / J. Phys. Chem. B by Bordiga (2002)
10.1023/A:1020504115146 / Top. Catal. by Zecchina (2002)
10.1021/jp036166e / J. Phys. Chem. B by Bonino (2004)
10.1039/b706637f / Phys. Chem. Chem. Phys. by Bordiga (2007)
10.1016/j.ccr.2014.05.013 / Coord. Chem. Rev. by van Bokhoven (2014)
10.1021/acs.jpcc.6b05087 / J. Phys. Chem. C by Doug (2016)
10.1039/c1cp21556f / Phys. Chem. Chem. Phys. by Gallo (2011)
10.1002/cphc.201200893 / ChemPhysChem by Gallo (2013)
10.1002/(SICI)1521-3773(19990802)38:15<2220::AID-ANIE2220>3.0.CO;2-G / Angew. Chem.-Int. Edit. by Li (1999)
10.1021/jp0042359 / J. Phys. Chem. B by Li (2001)
10.1002/anie.200290032 / Angew. Chem.-Int. Edit. by Bordiga (2002)
10.1039/b306041c / Phys. Chem. Chem. Phys. by Bordiga (2003)
10.1002/chem.201201319 / Chem.-Eur. J. by Guo (2012)
10.1021/jp310900a / J. Phys. Chem. C by Guo (2013)
10.1006/jcat.1999.2403 / J. Catal. by Lamberti (1999)
10.1107/S0108768199008927 / Acta Crystallogr. Sect. B-Struct. Sci. by Artioli (2000)
10.1021/ja003657t / J. Am. Chem. Soc. by Lamberti (2001)
10.1021/jp002167k / J. Phys. Chem. B by Hijar (2000)
10.1021/jp0107715 / J. Phys. Chem. B by Henry (2001)
10.1021/acs.jpcc.7b10104 / J. Phys. Chem. C by Signorile (2018)
10.1016/S1387-1811(00)00244-4 / Microporous Mesoporous Mater. by Marra (2000)
10.1002/qua.24658 / Int. J. Quantum Chem. by Dovesi (2014)
10.1039/C5CP04189A / Phys. Chem. Chem. Phys. by Fischer (2015)
10.1002/anie.201503476 / Angew. Chem.-Int. Edit. by Wagner (2015)
10.1039/C6CP02289H / Phys. Chem. Chem. Phys. by Fischer (2016)
10.1002/jcc.24509 / J. Comput. Chem. by Signorile (2016)
10.1088/1742-6596/190/1/012043 / Conf. Ser. by Di Cicco (2009)
10.1016/S0168-583X(02)01719-6 / Nucl. Instrum. Methods Phys. Res. Sect. B-Beam Interact. Mater. Atoms by Lamberti (2003)
10.1126/science.1155200 / Science by Teschner (2008)
10.1016/j.cattod.2016.02.065 / Catal. Today by Bugaev (2017)
10.1016/0038-1098(93)90193-Q / Solid State Commun. by Soldatov (1993)
10.1088/1742-6596/430/1/012028 / J. Phys. Conf. Ser. by Bugaev (2013)
10.1021/jp500734p / J. Phys. Chem. C by Bugaev (2014)
10.3103/S1062873815010098 / Bull. Russ. Acad. Sci: Phys. by Bugaev (2015)
10.1088/1742-6596/712/1/012032 / J. Phys. Conf. Ser. by Bugaev (2016)
10.1021/acs.jpcc.7b04152 / J. Phys. Chem. C by Bugaev (2017)
10.1021/acs.jpcc.7b11473 / J. Phys. Chem. C by Bugaev (2018)
{'journal-title': 'Faraday Discuss.', 'year': '2018', 'author': 'Bugaev', 'key': '10.1016/j.cattod.2018.10.071_bib1435'} / Faraday Discuss. by Bugaev (2018)
{'journal-title': 'Faraday Discuss.', 'year': '2018', 'author': 'Bugaev', 'key': '10.1016/j.cattod.2018.10.071_bib1440'} / Faraday Discuss. by Bugaev (2018)
10.1107/S0909049505038975 / J. Synchrot. Radiat. by Smolentsev (2006)
10.1016/j.commatsci.2006.08.007 / Comput. Mater. Sci. by Smolentsev (2007)
10.1039/C8CS00373D / Chem. Soc. Rev. by Borfecchia (2018)
10.1039/C0CC04218H / Chem. Commun. (Camb.) by Korhonen (2011)
10.1021/jp212450d / J. Phys. Chem. C by Deka (2012)
10.1021/cs300794s / ACS Catal. by Deka (2013)
10.1039/C3CP54132K / Phys. Chem. Chem. Phys. by Lezcano-Gonzalez (2014)
10.1016/j.jcat.2014.01.004 / J. Catal. by Bates (2014)
10.1039/C4SC02907K / Chem. Sci. by Borfecchia (2015)
10.1021/cs501673g / ACS Catal. by Janssens (2015)
10.1088/1742-6596/712/1/012041 / J. Phys. Conf. Ser. by Lomachenko (2016)
10.1021/jacs.6b06809 / J. Am. Chem. Soc. by Lomachenko (2016)
10.1021/jacs.6b02651 / J. Am. Chem. Soc. by Paolucci (2016)
10.1126/science.aan5630 / Science by Paolucci (2017)
10.1039/C4CC09645B / Chem. Commun. by Wulfers (2015)
10.1021/acscentsci.6b00139 / ACS Cent. Sci. by Narsimhan (2016)
10.1021/jacs.7b06472 / J. Am. Chem. Soc. by Pappas (2017)
10.1007/s11244-018-1036-9 / Top. Catal. by Martini (2018)
10.1021/jp9601577 / J. Phys. Chem. B by Lamberti (1997)
10.1021/jp993893u / J. Phys. Chem. B by Palomino (2000)
10.1021/jp0275847 / J. Phys. Chem. B by Llabrés i Xamena (2003)
10.1039/c3dt50732g / Dalton Trans. by Giordanino (2013)
10.1016/j.elspec.2012.09.004 / J. Electron Spectrosc. Relat. Phenom. by Glatzel (2013)
10.1021/acscatal.6b03005 / ACS Catal. by Ipek (2017)
10.1021/jacs.8b08071 / J. Am. Chem. Soc. by Pappas (2018)
10.1039/B618320B / Chem. Soc. Rev. by Ferey (2008)
10.1039/b807086p / Chem. Soc. Rev. by Perry (2009)
10.1021/cm1022882 / Chem. Mat. by Valenzano (2011)
10.1021/cr200205j / Chem. Rev. by O’Keeffe (2012)
10.1021/cr200304e / Chem. Rev. by Stock (2012)
10.1021/cr3002824 / Chem. Rev. by Cook (2013)
10.1039/C4CS00003J / Chem. Soc. Rev. by Lu (2014)
10.1070/RCR4554 / Russ. Chem. Rev. by Butova (2016)
10.1021/acs.chemrev.6b00346 / Chem. Rev. by Schoedel (2016)
10.1039/b804680h / Chem. Soc. Rev. by Czaja (2009)
10.1021/ja0523082 / J. Am. Chem. Soc. by Dinca (2005)
10.1039/b810574j / Chem. Commun. by Dietzel (2008)
10.1021/ja8007159 / J. Am. Chem. Soc. by Vitillo (2008)
10.1039/b802256a / Chem. Soc. Rev. by Murray (2009)
10.1021/cr200274s / Chem. Rev. by Suh (2012)
10.1021/acs.chemrev.7b00095 / Chem. Rev. by Shah (2017)
10.1021/acs.cgd.7b00166 / Cryst. Growth Des. by Yang (2017)
10.1016/j.mattod.2017.07.006 / Mater. Today by Li (2018)
10.1039/b807080f / Chem. Soc. Rev. by Lee (2009)
10.1002/anie.200806063 / Angew. Chem.-Int. Edit. by Farrusseng (2009)
10.1039/b807083k / Chem. Soc. Rev. by Ma (2009)
10.1021/cr9003924 / Chem. Rev. by Corma (2010)
10.1021/cr2003147 / Chem. Rev. by Yoon (2012)
{'year': '2013', 'series-title': 'Metal Organic Frameworks As Heterogeneous Catalysts', 'author': 'Llabrés i Xamena', 'key': '10.1016/j.cattod.2018.10.071_bib1685'} / Metal Organic Frameworks As Heterogeneous Catalysts by Llabrés i Xamena (2013)
10.1038/nchem.1956 / Nat. Chem. by Xiao (2014)
10.1039/C4CS00094C / Chem. Soc. Rev. by Liu (2014)
10.1016/j.ccr.2016.03.003 / Coord. Chem. Rev. by Zhan (2016)
10.1039/C6CS00250A / Chem. Soc. Rev. by Huang (2017)
10.1016/j.ccr.2017.02.010 / Coord. Chem. Rev. by Zhao (2017)
10.1016/j.ccr.2018.02.008 / Coord. Chem. Rev. by Chen (2018)
10.1016/j.ccr.2017.11.028 / Coord. Chem. Rev. by Kempahanumakkagari (2018)
10.1039/C8CC00789F / Chem. Commun. by Zhang (2018)
10.1021/cs3005874 / ACS Catal. by Wang (2012)
10.1002/anie.201108357 / Angew. Chem.-Int. Edit. by Fu (2012)
10.1002/anie.201202471 / Angew. Chem.-Int. Edit. by Fateeva (2012)
10.1002/anie.201505581 / Angew. Chem.-Int. Edit. by Dhakshinamoorthy (2016)
10.1021/ic301280n / Inorg. Chem. by Chen (2012)
10.1002/cplu.201200186 / ChemPlusChem by Shih (2012)
10.1021/ar400265x / Acc. Chem. Res. by Zhao (2014)
10.1039/C4SC03367A / Chem. Sci. by Huo (2015)
10.1021/ja513058h / J. Am. Chem. Soc. by Shieh (2015)
10.1039/C4CS00395K / Chem. Soc. Rev. by Chughtai (2015)
10.1039/C7CS00058H / Chem. Soc. Rev. by Lian (2017)
10.1039/C7NJ03619A / New J. Chem. by Samui (2018)
10.1002/anie.200501508 / Angew. Chem.-Int. Ed. by Dietzel (2005)
10.1039/b515434k / Chem. Commun. by Dietzel (2006)
10.1021/ja807023q / J. Am. Chem. Soc. by Zhou (2008)
10.1039/c3dt51312b / Dalton Trans. by Chavan (2013)
M.T. Kapelewski, S.J. Geier, M.R. Hudson, D. Stück, J.A. Mason, J.N. Nelson, D.J. Xiao, Z. Hulvey, E. Gilmour, S.A. FitzGerald, M. Head-Gordon, C.M. Brown, J.R. Long, 136 (2014) 12119-12129.
10.1039/b911242a / J. Mater. Chem. by Dietzel (2009)
10.1021/ja4045289 / J. Am. Chem. Soc. by Peng (2013)
10.1039/b907258f / Phys. Chem. Chem. Phys. by Chavan (2009)
10.1021/ja8036096 / J. Am. Chem. Soc. by Caskey (2008)
10.1039/C4SC02064B / Chem. Sci. by Queen (2014)
10.1021/jp205869k / J. Phys. Chem. C by Valenzano (2011)
10.1021/jp809872w / J. Phys. Chem. C by Chavan (2009)
10.1021/ja505318p / J. Am. Chem. Soc. by Bloch (2014)
10.1021/cm800686k / Chem. Mat. by Bonino (2008)
10.1016/j.cattod.2011.07.020 / Catal. Today by Valenzano (2012)
10.1021/ja205976v / J. Am. Chem. Soc. by Bloch (2011)
10.1021/jp402440u / J. Phys. Chem. C by Chavan (2013)
10.1039/C5CP01063B / Phys. Chem. Chem. Phys. by Van de Voorde (2015)
10.1103/PhysRevB.54.11169 / Phys. Rev. B by Kresse (1996)
10.1103/PhysRevB.59.1758 / Phys. Rev. B by Kresse (1999)
10.1002/jcc.21057 / J. Comput. Chem. by Hafner (2008)
10.1103/PhysRevLett.77.3865 / Phys. Rev. Lett. by Perdew (1996)
10.1021/ja045561v / J. Am. Chem. Soc. by Hayakawa (2004)
{'key': '10.1016/j.cattod.2018.10.071_bib1905', 'first-page': '57', 'article-title': 'Bond length determination using XANES', 'volume': 'Vol 27', 'author': 'Bianconi', 'year': '1983'} / Bond length determination using XANES by Bianconi (1983)
{'key': '10.1016/j.cattod.2018.10.071_bib1910', 'first-page': '38', 'article-title': 'Distance dependence of continuum and bound state of excitonic resonances in X-ray absorption near edge structure (XANES)', 'volume': 'Vol 2', 'author': 'Natoli', 'year': '1984'} / Distance dependence of continuum and bound state of excitonic resonances in X-ray absorption near edge structure (XANES) by Natoli (1984)
10.1016/S0167-5729(97)00011-3 / Surf. Sci. Rep. by Chen (1997)
10.1039/B509853J / Chem. Soc. Rev. by Hahner (2006)
10.1038/nmat2399 / Nat. Mater. by Ade (2009)
10.1002/pssb.200945067 / Phys. Status Solidi B-Basic Solid State Phys. by Havecker (2009)
10.1088/0953-8984/27/8/083003 / J. Phys.-Condes. Matter by Toyoshima (2015)
10.1002/anie.201008214 / Angew. Chem.-Int. Edit. by Somorjai (2011)
10.1063/1.5019333 / Rev. Sci. Instrum. by Castan-Guerrero (2018)
10.1021/acs.langmuir.8b00028 / Langmuir by Borgatti (2018)
{'key': '10.1016/j.cattod.2018.10.071_bib1955', 'series-title': 'X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications', 'first-page': '125', 'article-title': 'Hard X-ray photon-in/photon-out spectroscopy: instrumentation, theory and applications', 'author': 'Glatzel', 'year': '2016'} / X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications / Hard X-ray photon-in/photon-out spectroscopy: instrumentation, theory and applications by Glatzel (2016)

Dates

Type	When
Created	6 years, 9 months ago (Nov. 8, 2018, 12:11 p.m.)
Deposited	1 year, 1 month ago (July 12, 2024, 1:50 a.m.)
Indexed	2 months, 4 weeks ago (May 29, 2025, 8:29 a.m.)
Issued	5 years, 10 months ago (Oct. 1, 2019)
Published	5 years, 10 months ago (Oct. 1, 2019)
Published Print	5 years, 10 months ago (Oct. 1, 2019)

Funders 5

Russian Federation Government
Awards1
1. 14.Y26.31.0001
Russian Foundation
Awards1
1. #18-32-00856
Innovation Fund Denmark 10.13039/100012774 Innovationsfonden
Region: Europe
gov (National government)
Labels3
1. Innovation Fund Denmark
2. Innovation Fund
3. IFD
Evonik Resource Efficiency
Chimet SpA

BibTeX

@article{Guda_2019, title={Quantitative structural determination of active sites from in situ and operando XANES spectra: From standard ab initio simulations to chemometric and machine learning approaches}, volume={336}, ISSN={0920-5861}, url={http://dx.doi.org/10.1016/j.cattod.2018.10.071}, DOI={10.1016/j.cattod.2018.10.071}, journal={Catalysis Today}, publisher={Elsevier BV}, author={Guda, Alexander A. and Guda, Sergey A. and Lomachenko, Kirill A. and Soldatov, Mikhail A. and Pankin, Ilia A. and Soldatov, Alexander V. and Braglia, Luca and Bugaev, Aram L. and Martini, Andrea and Signorile, Matteo and Groppo, Elena and Piovano, Alessandro and Borfecchia, Elisa and Lamberti, Carlo}, year={2019}, month=oct, pages={3–21} }

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      "journal-title": "Phys. Rev."
    },
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      "DOI": "10.1007/BF01356225",
      "volume": "3",
      "author": "Hertz",
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      "journal-title": "Z. Phys."
    },
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      "DOI": "10.1007/BF01327991",
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      "DOI": "10.1007/BF02980572",
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      "journal-title": "Z. Phys."
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      "DOI": "10.1007/BF01336770",
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      "journal-title": "Z. Phys."
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      "DOI": "10.1007/BF01339580",
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      "author": "Coster",
      "year": "1931",
      "journal-title": "Z. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0045",
      "doi-asserted-by": "crossref",
      "first-page": "191",
      "DOI": "10.1007/BF01342373",
      "volume": "74",
      "author": "Coster",
      "year": "1932",
      "journal-title": "Z. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0050",
      "doi-asserted-by": "crossref",
      "first-page": "525",
      "DOI": "10.1103/PhysRev.26.525",
      "volume": "26",
      "author": "Chamberlain",
      "year": "1925",
      "journal-title": "Phys. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0055",
      "doi-asserted-by": "crossref",
      "first-page": "119",
      "DOI": "10.1007/BF01341219",
      "volume": "55",
      "author": "Ray",
      "year": "1929",
      "journal-title": "Z. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0060",
      "doi-asserted-by": "crossref",
      "first-page": "845",
      "DOI": "10.1080/14786441208564948",
      "volume": "8",
      "author": "Yost",
      "year": "1929",
      "journal-title": "Philos. Mag."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0065",
      "doi-asserted-by": "crossref",
      "first-page": "648",
      "DOI": "10.1103/PhysRev.36.648",
      "volume": "36",
      "author": "Kievit",
      "year": "1930",
      "journal-title": "Phys. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0070",
      "doi-asserted-by": "crossref",
      "first-page": "715",
      "DOI": "10.1103/PhysRev.37.715",
      "volume": "37",
      "author": "Hanawalt",
      "year": "1931",
      "journal-title": "Phys. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0075",
      "doi-asserted-by": "crossref",
      "first-page": "293",
      "DOI": "10.1007/BF01339579",
      "volume": "70",
      "author": "Hanawalt",
      "year": "1931",
      "journal-title": "Z. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0080",
      "doi-asserted-by": "crossref",
      "first-page": "163",
      "DOI": "10.1088/0959-5309/46/2/304",
      "volume": "46",
      "author": "Rao",
      "year": "1934",
      "journal-title": "Proc. Phys. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0085",
      "doi-asserted-by": "crossref",
      "first-page": "1012",
      "DOI": "10.1103/RevModPhys.35.1012",
      "volume": "35",
      "author": "Azaroff",
      "year": "1963",
      "journal-title": "Rev. Mod. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0090",
      "doi-asserted-by": "crossref",
      "first-page": "1204",
      "DOI": "10.1103/PhysRevLett.27.1204",
      "volume": "27",
      "author": "Sayers",
      "year": "1971",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0095",
      "doi-asserted-by": "crossref",
      "first-page": "4825",
      "DOI": "10.1103/PhysRevB.11.4825",
      "volume": "11",
      "author": "Lytle",
      "year": "1975",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0100",
      "doi-asserted-by": "crossref",
      "first-page": "4836",
      "DOI": "10.1103/PhysRevB.11.4836",
      "volume": "11",
      "author": "Stern",
      "year": "1975",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0105",
      "doi-asserted-by": "crossref",
      "first-page": "185",
      "DOI": "10.1107/S0909049596005651",
      "volume": "3",
      "author": "Binsted",
      "year": "1996",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0110",
      "doi-asserted-by": "crossref",
      "first-page": "621",
      "DOI": "10.1103/RevModPhys.72.621",
      "volume": "72",
      "author": "Rehr",
      "year": "2000",
      "journal-title": "Rev. Mod. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0115",
      "series-title": "X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications",
      "first-page": "51",
      "article-title": "Real-space multiple-scattering theory of X-ray spectra",
      "author": "Kas",
      "year": "2016"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0120",
      "doi-asserted-by": "crossref",
      "first-page": "265",
      "DOI": "10.1016/0038-1098(91)90194-Z",
      "volume": "78",
      "author": "Filipponi",
      "year": "1991",
      "journal-title": "Solid State Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0125",
      "doi-asserted-by": "crossref",
      "first-page": "15122",
      "DOI": "10.1103/PhysRevB.52.15122",
      "volume": "52",
      "author": "Filipponi",
      "year": "1995",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0130",
      "doi-asserted-by": "crossref",
      "first-page": "15135",
      "DOI": "10.1103/PhysRevB.52.15135",
      "volume": "52",
      "author": "Filipponi",
      "year": "1995",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0135",
      "series-title": "X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications",
      "first-page": "3",
      "article-title": "Introduction: historical perspective on XAS",
      "author": "Lamberti",
      "year": "2016"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0140",
      "doi-asserted-by": "crossref",
      "first-page": "392",
      "DOI": "10.1016/0378-5963(80)90024-0",
      "volume": "6",
      "author": "Bianconi",
      "year": "1980",
      "journal-title": "Appl. Surf. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0145",
      "doi-asserted-by": "crossref",
      "first-page": "149",
      "DOI": "10.1016/S0360-0564(08)60602-1",
      "volume": "12",
      "author": "Van Nordsthand",
      "year": "1960",
      "journal-title": "Adv. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0150",
      "doi-asserted-by": "crossref",
      "first-page": "613",
      "DOI": "10.1016/0038-1098(93)90123-5",
      "volume": "87",
      "author": "Li",
      "year": "1993",
      "journal-title": "Solid State Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0155",
      "doi-asserted-by": "crossref",
      "first-page": "195",
      "DOI": "10.1007/BF00824045",
      "volume": "26",
      "author": "Bordiga",
      "year": "1994",
      "journal-title": "Catal. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0160",
      "doi-asserted-by": "crossref",
      "first-page": "486",
      "DOI": "10.1006/jcat.1996.0048",
      "volume": "158",
      "author": "Bordiga",
      "year": "1996",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0165",
      "doi-asserted-by": "crossref",
      "first-page": "6885",
      "DOI": "10.1103/PhysRevB.43.6885",
      "volume": "43",
      "author": "Bianconi",
      "year": "1991",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0170",
      "doi-asserted-by": "crossref",
      "first-page": "5997",
      "DOI": "10.1103/PhysRevB.46.5997",
      "volume": "46",
      "author": "Tyson",
      "year": "1992",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0175",
      "doi-asserted-by": "crossref",
      "first-page": "976",
      "DOI": "10.1039/B920681G",
      "volume": "46",
      "author": "Gianolio",
      "year": "2010",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0180",
      "doi-asserted-by": "crossref",
      "first-page": "19839",
      "DOI": "10.1021/jp305756k",
      "volume": "116",
      "author": "Borfecchia",
      "year": "2012",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0185",
      "doi-asserted-by": "crossref",
      "first-page": "4512",
      "DOI": "10.1021/acs.jctc.5b00327",
      "volume": "11",
      "author": "Guda",
      "year": "2015",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0190",
      "doi-asserted-by": "crossref",
      "first-page": "012004",
      "DOI": "10.1088/1742-6596/712/1/012004",
      "volume": "712",
      "author": "Guda",
      "year": "2016",
      "journal-title": "J. Phys. Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0195",
      "doi-asserted-by": "crossref",
      "first-page": "89",
      "DOI": "10.1016/j.cattod.2016.02.039",
      "volume": "283",
      "author": "Braglia",
      "year": "2017",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0200",
      "doi-asserted-by": "crossref",
      "first-page": "277",
      "DOI": "10.1039/C7FD00024C",
      "volume": "201",
      "author": "Braglia",
      "year": "2017",
      "journal-title": "Faraday Discuss."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0205",
      "doi-asserted-by": "crossref",
      "first-page": "5992",
      "DOI": "10.1021/jacs.7b02161",
      "volume": "139",
      "author": "Tulchinsky",
      "year": "2017",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0210",
      "doi-asserted-by": "crossref",
      "first-page": "277",
      "DOI": "10.1016/j.jallcom.2017.11.062",
      "volume": "735",
      "author": "Pankin",
      "year": "2018",
      "journal-title": "J. Alloys. Compd."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0215",
      "doi-asserted-by": "crossref",
      "first-page": "8543",
      "DOI": "10.1021/acs.jpcc.7b12797",
      "volume": "122",
      "author": "Soldatov",
      "year": "2018",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0220",
      "doi-asserted-by": "crossref",
      "first-page": "26",
      "DOI": "10.1107/S0909049502017247",
      "volume": "10",
      "author": "Natoli",
      "year": "2003",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0225",
      "doi-asserted-by": "crossref",
      "first-page": "131",
      "DOI": "10.1016/j.ccr.2004.02.014",
      "volume": "249",
      "author": "Rehr",
      "year": "2005",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0230",
      "doi-asserted-by": "crossref",
      "first-page": "423001",
      "DOI": "10.1088/0022-3727/46/42/423001",
      "volume": "46",
      "author": "Mino",
      "year": "2013",
      "journal-title": "J. Phys. D-Appl. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0235",
      "doi-asserted-by": "crossref",
      "first-page": "130",
      "DOI": "10.1016/j.ccr.2014.03.027",
      "volume": "277",
      "author": "Garino",
      "year": "2014",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0240",
      "series-title": "X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications",
      "first-page": "73",
      "article-title": "Theory of X-ray absorption near edge structure",
      "author": "Joly",
      "year": "2016"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0245",
      "doi-asserted-by": "crossref",
      "first-page": "2987",
      "DOI": "10.1039/f19888402987",
      "volume": "84",
      "author": "Tanaka",
      "year": "1988",
      "journal-title": "J. Chem. Soc.-Faraday Trans. I"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0250",
      "doi-asserted-by": "crossref",
      "first-page": "10897",
      "DOI": "10.1021/j100027a034",
      "volume": "99",
      "author": "Hu",
      "year": "1995",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0255",
      "doi-asserted-by": "crossref",
      "first-page": "3245",
      "DOI": "10.1039/FT9959103245",
      "volume": "91",
      "author": "Weckhuysen",
      "year": "1995",
      "journal-title": "J. Chem. Soc.-Faraday Trans."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0260",
      "doi-asserted-by": "crossref",
      "first-page": "500",
      "DOI": "10.1016/S0009-2614(97)00297-2",
      "volume": "269",
      "author": "Lamberti",
      "year": "1997",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0265",
      "doi-asserted-by": "crossref",
      "first-page": "1519",
      "DOI": "10.1039/a708778k",
      "volume": "94",
      "author": "Lamberti",
      "year": "1998",
      "journal-title": "J. Chem. Soc.-Faraday Trans."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0270",
      "doi-asserted-by": "crossref",
      "first-page": "9248",
      "DOI": "10.1063/1.1319318",
      "volume": "113",
      "author": "Bolis",
      "year": "2000",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0275",
      "doi-asserted-by": "crossref",
      "first-page": "2138",
      "DOI": "10.1002/1521-3773(20000616)39:12<2138::AID-ANIE2138>3.0.CO;2-9",
      "volume": "39",
      "author": "Lamberti",
      "year": "2000",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0280",
      "doi-asserted-by": "crossref",
      "first-page": "319",
      "DOI": "10.1021/jp993224g",
      "volume": "104",
      "author": "Rodriguez",
      "year": "2000",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0285",
      "doi-asserted-by": "crossref",
      "first-page": "258",
      "DOI": "10.1006/jcat.2001.3257",
      "volume": "201",
      "author": "Sun",
      "year": "2001",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0290",
      "doi-asserted-by": "crossref",
      "first-page": "1911",
      "DOI": "10.1063/1.1432688",
      "volume": "116",
      "author": "Ankudinov",
      "year": "2002",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0295",
      "doi-asserted-by": "crossref",
      "first-page": "59",
      "DOI": "10.1081/CR-120001459",
      "volume": "44",
      "author": "Fernandez-Garcia",
      "year": "2002",
      "journal-title": "Catal. Rev.-Sci. Eng."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0300",
      "doi-asserted-by": "crossref",
      "first-page": "2402",
      "DOI": "10.1039/b207159b",
      "author": "Izumi",
      "year": "2002",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0305",
      "doi-asserted-by": "crossref",
      "first-page": "2341",
      "DOI": "10.1002/1521-3773(20020703)41:13<2341::AID-ANIE2341>3.0.CO;2-P",
      "volume": "41",
      "author": "Lamberti",
      "year": "2002",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0310",
      "doi-asserted-by": "crossref",
      "first-page": "389",
      "DOI": "10.1016/S0009-2614(02)01183-1",
      "volume": "363",
      "author": "Prestipino",
      "year": "2002",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0315",
      "doi-asserted-by": "crossref",
      "first-page": "12398",
      "DOI": "10.1021/jp0223051",
      "volume": "107",
      "author": "Bazin",
      "year": "2003",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0320",
      "doi-asserted-by": "crossref",
      "first-page": "4502",
      "DOI": "10.1039/B305810G",
      "volume": "5",
      "author": "Lamberti",
      "year": "2003",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0325",
      "doi-asserted-by": "crossref",
      "first-page": "777",
      "DOI": "10.1021/ja048225n",
      "volume": "127",
      "author": "Tromp",
      "year": "2005",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0330",
      "doi-asserted-by": "crossref",
      "first-page": "8094",
      "DOI": "10.1021/ja0689233",
      "volume": "129",
      "author": "Bus",
      "year": "2007",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0335",
      "doi-asserted-by": "crossref",
      "first-page": "177",
      "DOI": "10.1016/j.apcata.2007.07.027",
      "volume": "333",
      "author": "Jacobs",
      "year": "2007",
      "journal-title": "Appl. Catal. A-Gen."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0340",
      "doi-asserted-by": "crossref",
      "first-page": "9269",
      "DOI": "10.1002/anie.200802815",
      "volume": "47",
      "author": "Groppo",
      "year": "2008",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0345",
      "doi-asserted-by": "crossref",
      "first-page": "209",
      "DOI": "10.1016/j.jcat.2009.09.018",
      "volume": "268",
      "author": "Oyama",
      "year": "2009",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0350",
      "doi-asserted-by": "crossref",
      "first-page": "174508",
      "DOI": "10.1063/1.3125940",
      "volume": "130",
      "author": "Smolentsev",
      "year": "2009",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0355",
      "doi-asserted-by": "crossref",
      "first-page": "5707",
      "DOI": "10.1039/b925910b",
      "volume": "12",
      "author": "Chen",
      "year": "2010",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0360",
      "doi-asserted-by": "crossref",
      "first-page": "5605",
      "DOI": "10.1039/b926502n",
      "volume": "12",
      "author": "Muddada",
      "year": "2010",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0365",
      "doi-asserted-by": "crossref",
      "first-page": "5514",
      "DOI": "10.1039/b927120c",
      "volume": "12",
      "author": "Ramaker",
      "year": "2010",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0370",
      "doi-asserted-by": "crossref",
      "first-page": "289",
      "DOI": "10.1016/j.cattod.2009.10.010",
      "volume": "155",
      "author": "Ronning",
      "year": "2010",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0375",
      "doi-asserted-by": "crossref",
      "first-page": "288",
      "DOI": "10.1016/j.jcat.2010.12.016",
      "volume": "278",
      "author": "Liu",
      "year": "2011",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0380",
      "doi-asserted-by": "crossref",
      "first-page": "2242",
      "DOI": "10.1021/cs300445y",
      "volume": "2",
      "author": "Gaskell",
      "year": "2012",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0385",
      "doi-asserted-by": "crossref",
      "first-page": "53",
      "DOI": "10.1016/j.nimb.2011.08.004",
      "volume": "284",
      "author": "Gianolio",
      "year": "2012",
      "journal-title": "Nucl. Instrum. Methods Phys. Res. Sect. B-Beam Interact. Mater. Atoms"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0390",
      "doi-asserted-by": "crossref",
      "first-page": "488",
      "DOI": "10.1021/ja310111p",
      "volume": "135",
      "author": "He",
      "year": "2013",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0395",
      "doi-asserted-by": "crossref",
      "first-page": "6440",
      "DOI": "10.1002/anie.201300538",
      "volume": "52",
      "author": "Tougerti",
      "year": "2013",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0400",
      "doi-asserted-by": "crossref",
      "first-page": "1736",
      "DOI": "10.1021/cr2000898",
      "volume": "113",
      "author": "Bordiga",
      "year": "2013",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0405",
      "doi-asserted-by": "crossref",
      "first-page": "13006",
      "DOI": "10.1021/ja5062505",
      "volume": "136",
      "author": "Boubnov",
      "year": "2014",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0410",
      "doi-asserted-by": "crossref",
      "first-page": "1552",
      "DOI": "10.1021/jz500241m",
      "volume": "5",
      "author": "Giordanino",
      "year": "2014",
      "journal-title": "J. Phys. Chem. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0415",
      "doi-asserted-by": "crossref",
      "first-page": "12426",
      "DOI": "10.1002/anie.201403585",
      "volume": "53",
      "author": "Gorczyca",
      "year": "2014",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0420",
      "doi-asserted-by": "crossref",
      "first-page": "1650",
      "DOI": "10.1021/cs500148e",
      "volume": "4",
      "author": "Yao",
      "year": "2014",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0425",
      "doi-asserted-by": "crossref",
      "first-page": "10367",
      "DOI": "10.1002/anie.201703808",
      "volume": "56",
      "author": "Andersen",
      "year": "2017",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0430",
      "doi-asserted-by": "crossref",
      "first-page": "596",
      "DOI": "10.1021/acscatal.7b02946",
      "volume": "8",
      "author": "Stubbs",
      "year": "2018",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0435",
      "doi-asserted-by": "crossref",
      "first-page": "2850",
      "DOI": "10.1103/PhysRevLett.67.2850",
      "volume": "67",
      "author": "Hamalainen",
      "year": "1991",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0440",
      "doi-asserted-by": "crossref",
      "first-page": "65",
      "DOI": "10.1016/j.ccr.2004.04.011",
      "volume": "249",
      "author": "Glatzel",
      "year": "2005",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0445",
      "doi-asserted-by": "crossref",
      "first-page": "4754",
      "DOI": "10.1039/c0cs00054j",
      "volume": "39",
      "author": "Singh",
      "year": "2010",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0450",
      "doi-asserted-by": "crossref",
      "first-page": "908",
      "DOI": "10.1134/S1063774506060022",
      "volume": "51",
      "author": "Aksenov",
      "year": "2006",
      "journal-title": "Crystal. Rep."
    },
    {
      "year": "1950",
      "series-title": "Nuclear Physics",
      "author": "Fermi",
      "key": "10.1016/j.cattod.2018.10.071_bib0455"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0460",
      "series-title": "Surfaces and Interfaces of Electronic Materials",
      "first-page": "552",
      "article-title": "Appendix 6: derivation of Fermi\u2019s golden rule",
      "author": "Brillson",
      "year": "2010"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0465",
      "series-title": "Characterization of Semiconductor Heterostructures and Nanostructures",
      "first-page": "259",
      "article-title": "X-ray absorption fine structure in the study of semiconductor heterostructures and nanostructures",
      "author": "Boscherini",
      "year": "2013"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0470",
      "doi-asserted-by": "crossref",
      "first-page": "221",
      "DOI": "10.1016/B978-0-12-805090-3.00007-3",
      "volume": "177",
      "author": "Borfecchia",
      "year": "2017",
      "journal-title": "Stud. Surf. Sci. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0475",
      "first-page": "243",
      "volume": "114",
      "author": "Dirac",
      "year": "1927",
      "journal-title": "Proc. Roy. Soc. (London) A"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0480",
      "doi-asserted-by": "crossref",
      "first-page": "115",
      "DOI": "10.1002/open.201300012",
      "volume": "2",
      "author": "Steinmetz",
      "year": "2013",
      "journal-title": "ChemistryOpen"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0485",
      "doi-asserted-by": "crossref",
      "first-page": "10356",
      "DOI": "10.1021/ja990747t",
      "volume": "121",
      "author": "Rosa",
      "year": "1999",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0490",
      "doi-asserted-by": "crossref",
      "first-page": "5",
      "DOI": "10.1016/S0010-8545(02)00093-0",
      "volume": "230",
      "author": "Baerends",
      "year": "2002",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0495",
      "doi-asserted-by": "crossref",
      "first-page": "115",
      "DOI": "10.1016/S0009-2614(03)00543-8",
      "volume": "373",
      "author": "Stener",
      "year": "2003",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0500",
      "doi-asserted-by": "crossref",
      "first-page": "16835",
      "DOI": "10.1021/ja052467l",
      "volume": "127",
      "author": "Nazeeruddin",
      "year": "2005",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0505",
      "doi-asserted-by": "crossref",
      "first-page": "902",
      "DOI": "10.1002/qua.22041",
      "volume": "110",
      "author": "Luzanov",
      "year": "2010",
      "journal-title": "Int. J. Quantum Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0510",
      "doi-asserted-by": "crossref",
      "first-page": "6703",
      "DOI": "10.1021/om100734y",
      "volume": "29",
      "author": "Salassa",
      "year": "2010",
      "journal-title": "Organometallics"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0515",
      "doi-asserted-by": "crossref",
      "first-page": "5699",
      "DOI": "10.1002/chem.201001996",
      "volume": "17",
      "author": "Jaszewski",
      "year": "2011",
      "journal-title": "Chem.-Eur. J."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0520",
      "doi-asserted-by": "crossref",
      "first-page": "6564",
      "DOI": "10.1039/c3dt32865a",
      "volume": "42",
      "author": "Borfecchia",
      "year": "2013",
      "journal-title": "Dalton Trans."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0525",
      "doi-asserted-by": "crossref",
      "first-page": "104207",
      "DOI": "10.1088/0953-8984/21/10/104207",
      "volume": "21",
      "author": "de Groot",
      "year": "2009",
      "journal-title": "J. Phys. Condens. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0530",
      "doi-asserted-by": "crossref",
      "first-page": "31",
      "DOI": "10.1016/j.ccr.2004.03.018",
      "volume": "249",
      "author": "Groot",
      "year": "2005",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0535",
      "doi-asserted-by": "crossref",
      "first-page": "794",
      "DOI": "10.1103/PhysRevLett.80.794",
      "volume": "80",
      "author": "Shirley",
      "year": "1998",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0540",
      "doi-asserted-by": "crossref",
      "first-page": "1187",
      "DOI": "10.1016/j.elspec.2005.01.191",
      "volume": "144\u2013147",
      "author": "Shirley",
      "year": "2005",
      "journal-title": "J. Electron Spectrosc. Relat. Phenom."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0545",
      "doi-asserted-by": "crossref",
      "first-page": "4451",
      "DOI": "10.1039/b903676h",
      "volume": "11",
      "author": "Sagmeister",
      "year": "2009",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0550",
      "doi-asserted-by": "crossref",
      "first-page": "115106",
      "DOI": "10.1103/PhysRevB.83.115106",
      "volume": "83",
      "author": "Vinson",
      "year": "2011",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0555",
      "doi-asserted-by": "crossref",
      "first-page": "109",
      "DOI": "10.1016/j.cpc.2015.08.014",
      "volume": "197",
      "author": "Gilmore",
      "year": "2015",
      "journal-title": "Comput. Phys. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0560",
      "doi-asserted-by": "crossref",
      "first-page": "124116",
      "DOI": "10.1063/1.4896373",
      "volume": "141",
      "author": "Pinjari",
      "year": "2014",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0565",
      "doi-asserted-by": "crossref",
      "first-page": "3250",
      "DOI": "10.1039/C5CP07487H",
      "volume": "18",
      "author": "Guo",
      "year": "2016",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0570",
      "doi-asserted-by": "crossref",
      "first-page": "064202",
      "DOI": "10.1088/0953-8984/20/6/064202",
      "volume": "20",
      "author": "Held",
      "year": "2008",
      "journal-title": "J. Phys.-Condes. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0575",
      "doi-asserted-by": "crossref",
      "first-page": "237",
      "DOI": "10.1088/0034-4885/61/3/002",
      "volume": "61",
      "author": "Aryasetiawan",
      "year": "1998",
      "journal-title": "Rep. Prog. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0580",
      "doi-asserted-by": "crossref",
      "first-page": "035118",
      "DOI": "10.1103/PhysRevB.94.035118",
      "volume": "94",
      "author": "Nabok",
      "year": "2016",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0585",
      "doi-asserted-by": "crossref",
      "first-page": "601",
      "DOI": "10.1103/RevModPhys.74.601",
      "volume": "74",
      "author": "Onida",
      "year": "2002",
      "journal-title": "Rev. Mod. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0590",
      "doi-asserted-by": "crossref",
      "first-page": "548",
      "DOI": "10.1016/j.crhy.2008.08.004",
      "volume": "10",
      "author": "Rehr",
      "year": "2009",
      "journal-title": "Comptes Rendus Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0595",
      "doi-asserted-by": "crossref",
      "first-page": "125120",
      "DOI": "10.1103/PhysRevB.63.125120",
      "volume": "63",
      "author": "Joly",
      "year": "2001",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0600",
      "doi-asserted-by": "crossref",
      "first-page": "58",
      "DOI": "10.1107/S0909049502017211",
      "volume": "10",
      "author": "Joly",
      "year": "2003",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0605",
      "first-page": "391",
      "volume": "99",
      "author": "Fonseca Guerra",
      "year": "1998",
      "journal-title": "Theor. Chem. Acc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0610",
      "doi-asserted-by": "crossref",
      "first-page": "395502",
      "DOI": "10.1088/0953-8984/21/39/395502",
      "volume": "21",
      "author": "Giannozzi",
      "year": "2009",
      "journal-title": "J. Phys.-Condes. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0615",
      "doi-asserted-by": "crossref",
      "first-page": "574",
      "DOI": "10.1524/zkri.220.5.574.65062",
      "volume": "220",
      "author": "Scandolo",
      "year": "2005",
      "journal-title": "Z. Kristall."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0620",
      "first-page": "49",
      "volume": "32",
      "author": "Giannozzi",
      "year": "2009",
      "journal-title": "Nuovo Cimento Soc. Ital. Fis. C-Colloq. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0625",
      "doi-asserted-by": "crossref",
      "first-page": "52",
      "DOI": "10.1016/j.cpc.2017.01.008",
      "volume": "214",
      "author": "Barnes",
      "year": "2017",
      "journal-title": "Comput. Phys. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0630",
      "doi-asserted-by": "crossref",
      "first-page": "465901",
      "DOI": "10.1088/1361-648X/aa8f79",
      "volume": "29",
      "author": "Giannozzi",
      "year": "2017",
      "journal-title": "J. Phys.-Condes. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0635",
      "doi-asserted-by": "crossref",
      "first-page": "195107",
      "DOI": "10.1103/PhysRevB.66.195107",
      "volume": "66",
      "author": "Taillefumier",
      "year": "2002",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0640",
      "doi-asserted-by": "crossref",
      "first-page": "075102",
      "DOI": "10.1103/PhysRevB.80.075102",
      "volume": "80",
      "author": "Gougoussis",
      "year": "2009",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0645",
      "doi-asserted-by": "crossref",
      "first-page": "11694",
      "DOI": "10.1021/acs.inorgchem.6b01704",
      "volume": "55",
      "author": "Vollmers",
      "year": "2016",
      "journal-title": "Inorg. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0650",
      "doi-asserted-by": "crossref",
      "first-page": "931",
      "DOI": "10.1002/jcc.1056",
      "volume": "22",
      "author": "te Velde",
      "year": "2001",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0655",
      "doi-asserted-by": "crossref",
      "first-page": "73",
      "DOI": "10.1002/wcms.81",
      "volume": "2",
      "author": "Neese",
      "year": "2012",
      "journal-title": "Rev.-Comput. Mol. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0660",
      "doi-asserted-by": "crossref",
      "first-page": "e1327",
      "DOI": "10.1002/wcms.1327",
      "volume": "8",
      "author": "Neese",
      "year": "2018",
      "journal-title": "Rev.-Comput. Mol. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0665",
      "doi-asserted-by": "crossref",
      "first-page": "44",
      "DOI": "10.1016/j.ccr.2014.02.013",
      "volume": "277-278",
      "author": "Milne",
      "year": "2014",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0670",
      "doi-asserted-by": "crossref",
      "DOI": "10.1021/acs.chemrev.8b00156",
      "volume": "118",
      "author": "Norman",
      "year": "2018",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0675",
      "doi-asserted-by": "crossref",
      "first-page": "4583",
      "DOI": "10.1021/ct5006888",
      "volume": "10",
      "author": "Wenzel",
      "year": "2014",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0680",
      "doi-asserted-by": "crossref",
      "first-page": "20049",
      "DOI": "10.1021/acs.jpcc.6b06883",
      "volume": "120",
      "author": "Moonshiram",
      "year": "2016",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0685",
      "doi-asserted-by": "crossref",
      "first-page": "10586",
      "DOI": "10.1021/jacs.6b05680",
      "volume": "138",
      "author": "Moonshiram",
      "year": "2016",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0690",
      "doi-asserted-by": "crossref",
      "first-page": "5503",
      "DOI": "10.1039/b926434e",
      "volume": "12",
      "author": "Rehr",
      "year": "2010",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0695",
      "doi-asserted-by": "crossref",
      "first-page": "433",
      "DOI": "10.1002/pssb.2221110202",
      "volume": "111",
      "author": "Vedrinskii",
      "year": "1982",
      "journal-title": "Phys. Status Solidi B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0700",
      "doi-asserted-by": "crossref",
      "first-page": "175",
      "DOI": "10.1002/pssb.2221340122",
      "volume": "134",
      "author": "Datsyuk",
      "year": "1986",
      "journal-title": "Phys. Status Solidi B-Basic Res."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0705",
      "series-title": "Electronic Structure and Physical Properties of Solids: the Users of the LMTO Method",
      "first-page": "191",
      "article-title": "Fully relativistic band structure calculations for magnetic solids - formalism and application",
      "author": "Ebert",
      "year": "2000"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0710",
      "doi-asserted-by": "crossref",
      "first-page": "096501",
      "DOI": "10.1088/0034-4885/74/9/096501",
      "volume": "74",
      "author": "Ebert",
      "year": "2011",
      "journal-title": "Rep. Prog. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0715",
      "doi-asserted-by": "crossref",
      "first-page": "155501",
      "DOI": "10.1103/PhysRevLett.87.155501",
      "volume": "87",
      "author": "Della Longa",
      "year": "2001",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0720",
      "doi-asserted-by": "crossref",
      "first-page": "267",
      "DOI": "10.1107/S0909049500015338",
      "volume": "8",
      "author": "Benfatto",
      "year": "2001",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0725",
      "doi-asserted-by": "crossref",
      "first-page": "51",
      "DOI": "10.1107/S0909049502018137",
      "volume": "10",
      "author": "Benfatto",
      "year": "2003",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0730",
      "doi-asserted-by": "crossref",
      "first-page": "9652",
      "DOI": "10.1021/ic050703n",
      "volume": "44",
      "author": "Sarangi",
      "year": "2005",
      "journal-title": "Inorg. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0735",
      "doi-asserted-by": "crossref",
      "first-page": "111",
      "DOI": "10.1063/1.2644444",
      "volume": "882",
      "author": "Hayakawa",
      "year": "2007",
      "journal-title": "AIP Conf. Proc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0740",
      "doi-asserted-by": "crossref",
      "first-page": "012031",
      "DOI": "10.1088/1742-6596/190/1/012031",
      "volume": "190",
      "author": "Benfatto",
      "year": "2009",
      "journal-title": "J. Phys. Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0745",
      "series-title": "Gaussian 09, Revision A.02",
      "article-title": "Gaussian 09",
      "author": "Frisch",
      "year": "2016"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0750",
      "doi-asserted-by": "crossref",
      "first-page": "71",
      "DOI": "10.1016/S0010-4655(02)00206-0",
      "volume": "147",
      "author": "Schwarz",
      "year": "2002",
      "journal-title": "Comput. Phys. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0755",
      "doi-asserted-by": "crossref",
      "first-page": "259",
      "DOI": "10.1016/S0927-0256(03)00112-5",
      "volume": "28",
      "author": "Schwarz",
      "year": "2003",
      "journal-title": "Comput. Mater. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0760",
      "doi-asserted-by": "crossref",
      "first-page": "219",
      "DOI": "10.1016/S0968-4328(03)00030-1",
      "volume": "34",
      "author": "Hebert",
      "year": "2003",
      "journal-title": "Micron"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0765",
      "doi-asserted-by": "crossref",
      "first-page": "319",
      "DOI": "10.1016/S0022-4596(03)00213-5",
      "volume": "176",
      "author": "Schwarz",
      "year": "2003",
      "journal-title": "J. Solid State Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0770",
      "doi-asserted-by": "crossref",
      "first-page": "12",
      "DOI": "10.1016/j.micron.2006.03.010",
      "volume": "38",
      "author": "Hebert",
      "year": "2007",
      "journal-title": "Micron"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0775",
      "doi-asserted-by": "crossref",
      "first-page": "3147",
      "DOI": "10.1080/00268976.2010.506451",
      "volume": "108",
      "author": "Schwarz",
      "year": "2010",
      "journal-title": "Mol. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0780",
      "doi-asserted-by": "crossref",
      "first-page": "628",
      "DOI": "10.1016/j.cpc.2011.12.010",
      "volume": "183",
      "author": "Pardini",
      "year": "2012",
      "journal-title": "Comput. Phys. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0785",
      "doi-asserted-by": "crossref",
      "first-page": "165113",
      "DOI": "10.1103/PhysRevB.85.165113",
      "volume": "85",
      "author": "Haverkort",
      "year": "2012",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0790",
      "doi-asserted-by": "crossref",
      "first-page": "2788",
      "DOI": "10.1143/JPSJ.63.2788",
      "volume": "63",
      "author": "Tanaka",
      "year": "1994",
      "journal-title": "J. Phys. Soc. Jpn."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0795",
      "doi-asserted-by": "crossref",
      "first-page": "687",
      "DOI": "10.1016/j.micron.2010.06.005",
      "volume": "41",
      "author": "Stavitski",
      "year": "2010",
      "journal-title": "Micron"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0800",
      "doi-asserted-by": "crossref",
      "first-page": "222",
      "DOI": "10.1016/S0927-0256(03)00109-5",
      "volume": "28",
      "author": "Karlstrom",
      "year": "2003",
      "journal-title": "Comput. Mater. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0805",
      "doi-asserted-by": "crossref",
      "first-page": "224",
      "DOI": "10.1002/jcc.21318",
      "volume": "31",
      "author": "Aquilante",
      "year": "2010",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0810",
      "doi-asserted-by": "crossref",
      "first-page": "143",
      "DOI": "10.1002/wcms.1117",
      "volume": "3",
      "author": "Aquilante",
      "year": "2013",
      "journal-title": "Rev.-Comput. Mol. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0815",
      "doi-asserted-by": "crossref",
      "first-page": "506",
      "DOI": "10.1002/jcc.24221",
      "volume": "37",
      "author": "Aquilante",
      "year": "2016",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0820",
      "doi-asserted-by": "crossref",
      "first-page": "363202",
      "DOI": "10.1088/0953-8984/26/36/363202",
      "volume": "26",
      "author": "Gulans",
      "year": "2014",
      "journal-title": "J. Phys.-Condes. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0825",
      "doi-asserted-by": "crossref",
      "DOI": "10.1063/1.1839852",
      "volume": "122",
      "author": "Skylaris",
      "year": "2005",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0830",
      "doi-asserted-by": "crossref",
      "first-page": "846",
      "DOI": "10.1103/PhysRev.51.846",
      "volume": "51",
      "author": "Slater",
      "year": "1937",
      "journal-title": "Phys. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0835",
      "doi-asserted-by": "crossref",
      "first-page": "024105",
      "DOI": "10.1103/PhysRevB.82.024105",
      "volume": "82",
      "author": "Beale",
      "year": "2010",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0840",
      "doi-asserted-by": "crossref",
      "first-page": "14408",
      "DOI": "10.1021/acs.inorgchem.7b01471",
      "volume": "56",
      "author": "Gallo",
      "year": "2017",
      "journal-title": "Inorg. Chem."
    },
    {
      "year": "2016",
      "series-title": "Resolving Spectral Mixtures: With Applications From Ultrafast Time-resolved Spectroscopy to Super-resolution Imaging",
      "author": "Ruckebusch",
      "key": "10.1016/j.cattod.2018.10.071_bib0845"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0850",
      "doi-asserted-by": "crossref",
      "first-page": "133",
      "DOI": "10.1016/0169-7439(95)00047-X",
      "volume": "30",
      "author": "Tauler",
      "year": "1995",
      "journal-title": "Chemometr. Intell. Lab. Syst."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0855",
      "doi-asserted-by": "crossref",
      "first-page": "101",
      "DOI": "10.1016/j.chemolab.2004.12.007",
      "volume": "76",
      "author": "Jaumot",
      "year": "2005",
      "journal-title": "Chemometr. Intell. Lab."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0860",
      "doi-asserted-by": "crossref",
      "first-page": "1",
      "DOI": "10.1016/j.chemolab.2014.10.003",
      "volume": "140",
      "author": "Jaumot",
      "year": "2015",
      "journal-title": "Chemometr. Intell. Lab."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0865",
      "doi-asserted-by": "crossref",
      "first-page": "12565",
      "DOI": "10.1021/j100033a032",
      "volume": "99",
      "author": "Fernandez Garcia",
      "year": "1995",
      "journal-title": "J. Phys. Chem."
    },
    {
      "year": "2002",
      "series-title": "Factor Analysis in Chemistry",
      "author": "Malinowski",
      "key": "10.1016/j.cattod.2018.10.071_bib0870"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0875",
      "doi-asserted-by": "crossref",
      "first-page": "27489",
      "DOI": "10.1039/C7CP05185A",
      "volume": "19",
      "author": "Braglia",
      "year": "2017",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0880",
      "doi-asserted-by": "crossref",
      "first-page": "205",
      "DOI": "10.1016/0169-7439(88)80051-0",
      "volume": "3",
      "author": "Maeder",
      "year": "1988",
      "journal-title": "Chemometr. Intell. Lab. Syst."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0885",
      "doi-asserted-by": "crossref",
      "first-page": "1425",
      "DOI": "10.1021/ac00014a016",
      "volume": "63",
      "author": "Windig",
      "year": "1991",
      "journal-title": "Anal. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0890",
      "doi-asserted-by": "crossref",
      "first-page": "100",
      "DOI": "10.1016/j.chemolab.2011.05.009",
      "volume": "108",
      "author": "Abdollahi",
      "year": "2011",
      "journal-title": "Chemometr. Intell. Lab. Syst."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0895",
      "doi-asserted-by": "crossref",
      "first-page": "3629",
      "DOI": "10.1021/ac902865h",
      "volume": "82",
      "author": "Conti",
      "year": "2010",
      "journal-title": "Anal. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0900",
      "doi-asserted-by": "crossref",
      "first-page": "886",
      "DOI": "10.1021/acs.jpcc.6b10062",
      "volume": "121",
      "author": "Caetano",
      "year": "2017",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0905",
      "doi-asserted-by": "crossref",
      "first-page": "2855",
      "DOI": "10.1021/cm401352t",
      "volume": "25",
      "author": "Carvalho",
      "year": "2013",
      "journal-title": "Chem. Mat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0910",
      "doi-asserted-by": "crossref",
      "first-page": "114",
      "DOI": "10.1016/j.cattod.2013.10.077",
      "volume": "229",
      "author": "Cassinelli",
      "year": "2014",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0915",
      "doi-asserted-by": "crossref",
      "first-page": "20",
      "DOI": "10.1016/j.aca.2014.06.050",
      "volume": "840",
      "author": "Voronov",
      "year": "2014",
      "journal-title": "Anal. Chim. Acta"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0920",
      "doi-asserted-by": "crossref",
      "first-page": "1273",
      "DOI": "10.1021/cs501799p",
      "volume": "5",
      "author": "Hong",
      "year": "2015",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0925",
      "doi-asserted-by": "crossref",
      "first-page": "18544",
      "DOI": "10.1021/acs.jpcc.7b03735",
      "volume": "121",
      "author": "Rochet",
      "year": "2017",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0930",
      "doi-asserted-by": "crossref",
      "first-page": "3918",
      "DOI": "10.1002/cctc.201700319",
      "volume": "9",
      "author": "Passos",
      "year": "2017",
      "journal-title": "ChemCatChem"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0935",
      "doi-asserted-by": "crossref",
      "first-page": "3706",
      "DOI": "10.1021/jacs.6b11872",
      "volume": "139",
      "author": "Tsakoumis",
      "year": "2017",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0940",
      "doi-asserted-by": "crossref",
      "first-page": "6836",
      "DOI": "10.1039/C7SC02266B",
      "volume": "8",
      "author": "Martini",
      "year": "2017",
      "journal-title": "Chem. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0945",
      "doi-asserted-by": "crossref",
      "first-page": "1171",
      "DOI": "10.2138/am-2016-5556",
      "volume": "101",
      "author": "Dyar",
      "year": "2016",
      "journal-title": "Am. Mineral."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0950",
      "doi-asserted-by": "crossref",
      "first-page": "1725",
      "DOI": "10.1039/c2ja30149k",
      "volume": "27",
      "author": "Borfecchia",
      "year": "2012",
      "journal-title": "J. Anal. At. Spectrom."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0955",
      "doi-asserted-by": "crossref",
      "first-page": "72",
      "DOI": "10.1016/j.cattod.2013.11.002",
      "volume": "229",
      "author": "Mino",
      "year": "2014",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0960",
      "doi-asserted-by": "crossref",
      "first-page": "025007",
      "DOI": "10.1103/RevModPhys.90.025007",
      "volume": "90",
      "author": "Mino",
      "year": "2018",
      "journal-title": "Rev. Mod. Phys."
    },
    {
      "year": "2009",
      "series-title": "The Elements of Statistical Learning. Data Mining, Inference, and Prediction",
      "author": "Hastie",
      "key": "10.1016/j.cattod.2018.10.071_bib0965"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0970",
      "doi-asserted-by": "crossref",
      "first-page": "34",
      "DOI": "10.1186/1758-2946-5-34",
      "volume": "5",
      "author": "Qu",
      "year": "2013",
      "journal-title": "J. Cheminformatics"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0975",
      "doi-asserted-by": "crossref",
      "first-page": "11",
      "DOI": "10.1021/acs.jcim.6b00340",
      "volume": "57",
      "author": "Pereira",
      "year": "2017",
      "journal-title": "J. Chem. Inf. Model."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0980",
      "doi-asserted-by": "crossref",
      "first-page": "054104",
      "DOI": "10.1103/PhysRevB.88.054104",
      "volume": "88",
      "author": "Bartok",
      "year": "2013",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0985",
      "doi-asserted-by": "crossref",
      "first-page": "346",
      "DOI": "10.1080/08927022.2016.1274984",
      "volume": "43",
      "author": "Boes",
      "year": "2017",
      "journal-title": "Mol. Simul."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0990",
      "doi-asserted-by": "crossref",
      "DOI": "10.1038/s41467-017-00839-3",
      "volume": "8",
      "author": "Brockherde",
      "year": "2017",
      "journal-title": "Nat. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib0995",
      "doi-asserted-by": "crossref",
      "first-page": "8512",
      "DOI": "10.1038/s41598-017-08455-3",
      "volume": "7",
      "author": "Kruglov",
      "year": "2017",
      "journal-title": "Sci. Rep."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1000",
      "doi-asserted-by": "crossref",
      "first-page": "42669",
      "DOI": "10.1038/srep42669",
      "volume": "7",
      "author": "Hegde",
      "year": "2017",
      "journal-title": "Sci. Rep."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1005",
      "doi-asserted-by": "crossref",
      "first-page": "1064",
      "DOI": "10.1021/acs.jpclett.8b00170",
      "volume": "9",
      "author": "Janet",
      "year": "2018",
      "journal-title": "J. Phys. Chem. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1010",
      "doi-asserted-by": "crossref",
      "first-page": "12",
      "DOI": "10.1038/s41524-018-0067-x",
      "volume": "4",
      "author": "Zheng",
      "year": "2018",
      "journal-title": "npj Comput. Mater."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1015",
      "doi-asserted-by": "crossref",
      "first-page": "5091",
      "DOI": "10.1021/acs.jpclett.7b02364",
      "volume": "8",
      "author": "Timoshenko",
      "year": "2017",
      "journal-title": "J. Phys. Chem. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1020",
      "doi-asserted-by": "crossref",
      "first-page": "066117",
      "DOI": "10.1103/PhysRevE.80.066117",
      "volume": "80",
      "author": "Weinstein",
      "year": "2009",
      "journal-title": "Phys. Rev. E"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1025",
      "unstructured": "M. Weinstein, F. Meirer, A. Hume, P. Sciau, G. Shaked, R. Hofstetter, E. Persi, A. Mehta, D. Horn, arXiv:1310.2700v2 [physics.data-an], (2013)."
    },
    {
      "year": "2014",
      "series-title": "World Polyethylene, Industry Study With Forecast for 2018 & 2023",
      "author": "World Polyethylene",
      "key": "10.1016/j.cattod.2018.10.071_bib1030"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1035",
      "doi-asserted-by": "crossref",
      "first-page": "47",
      "DOI": "10.1016/S0360-0564(08)60258-8",
      "volume": "33",
      "author": "McDaniel",
      "year": "1985",
      "journal-title": "Adv. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1040",
      "doi-asserted-by": "crossref",
      "first-page": "115",
      "DOI": "10.1021/cr040083s",
      "volume": "105",
      "author": "Groppo",
      "year": "2005",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1045",
      "doi-asserted-by": "crossref",
      "first-page": "123",
      "DOI": "10.1016/S0360-0564(10)53003-7",
      "volume": "53",
      "author": "McDaniel",
      "year": "2010",
      "journal-title": "Adv. Catal."
    },
    {
      "year": "2014",
      "series-title": "Business and Technology of the Global Polyethylene Industry",
      "author": "Nowlin",
      "key": "10.1016/j.cattod.2018.10.071_bib1050"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1055",
      "unstructured": "J.P. Hogan, R.L. Banks, Patent U.S. Patent 2, 825, 721, (1958)."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1060",
      "doi-asserted-by": "crossref",
      "first-page": "3327",
      "DOI": "10.1021/cr940044o",
      "volume": "96",
      "author": "Weckhuysen",
      "year": "1996",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1065",
      "doi-asserted-by": "crossref",
      "first-page": "98",
      "DOI": "10.1016/j.jcat.2004.11.017",
      "volume": "230",
      "author": "Groppo",
      "year": "2005",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1070",
      "doi-asserted-by": "crossref",
      "first-page": "233",
      "DOI": "10.1016/j.jcat.2005.09.013",
      "volume": "236",
      "author": "Groppo",
      "year": "2005",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1075",
      "doi-asserted-by": "crossref",
      "first-page": "2019",
      "DOI": "10.1021/cm050043k",
      "volume": "17",
      "author": "Groppo",
      "year": "2005",
      "journal-title": "Chem. Mater."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1080",
      "doi-asserted-by": "crossref",
      "first-page": "2453",
      "DOI": "10.1039/b604515d",
      "volume": "8",
      "author": "Groppo",
      "year": "2006",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1085",
      "doi-asserted-by": "crossref",
      "first-page": "16437",
      "DOI": "10.1021/jp074066t",
      "volume": "111",
      "author": "Agostini",
      "year": "2007",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1090",
      "doi-asserted-by": "crossref",
      "first-page": "1465",
      "DOI": "10.1002/anie.200602593",
      "volume": "46",
      "author": "Nenu",
      "year": "2007",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1095",
      "doi-asserted-by": "crossref",
      "first-page": "2321",
      "DOI": "10.1021/cr100217q",
      "volume": "111",
      "author": "McGuinness",
      "year": "2011",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1100",
      "doi-asserted-by": "crossref",
      "first-page": "858",
      "DOI": "10.1039/C2CY20559A",
      "volume": "3",
      "author": "Groppo",
      "year": "2013",
      "journal-title": "Catal. Sci. Technol."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1105",
      "doi-asserted-by": "crossref",
      "first-page": "1872",
      "DOI": "10.1002/anie.201308983",
      "volume": "53",
      "author": "Conley",
      "year": "2014",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1110",
      "doi-asserted-by": "crossref",
      "first-page": "11624",
      "DOI": "10.1073/pnas.1405314111",
      "volume": "111",
      "author": "Delley",
      "year": "2014",
      "journal-title": "Proc. Natl. Acad. Sci. U. S. A."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1115",
      "doi-asserted-by": "crossref",
      "first-page": "5574",
      "DOI": "10.1021/acscatal.5b00927",
      "volume": "5",
      "author": "Brown",
      "year": "2015",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1120",
      "doi-asserted-by": "crossref",
      "first-page": "985",
      "DOI": "10.1007/s10562-014-1394-2",
      "volume": "145",
      "author": "Chakrabarti",
      "year": "2015",
      "journal-title": "Catal. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1125",
      "doi-asserted-by": "crossref",
      "first-page": "13073",
      "DOI": "10.1002/anie.201506718",
      "volume": "54",
      "author": "Cicmil",
      "year": "2015",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1130",
      "doi-asserted-by": "crossref",
      "first-page": "E4160",
      "DOI": "10.1073/pnas.1422589112",
      "volume": "112",
      "author": "Peters",
      "year": "2015",
      "journal-title": "Proc. Natl. Acad. Sci. U. S. A."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1135",
      "doi-asserted-by": "crossref",
      "first-page": "725",
      "DOI": "10.1007/s11244-016-0546-6",
      "volume": "59",
      "author": "Chakrabarti",
      "year": "2016",
      "journal-title": "Top. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1140",
      "doi-asserted-by": "crossref",
      "first-page": "1937",
      "DOI": "10.1002/cctc.201600200",
      "volume": "8",
      "author": "Cicmil",
      "year": "2016",
      "journal-title": "ChemCatChem"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1145",
      "doi-asserted-by": "crossref",
      "first-page": "731",
      "DOI": "10.1039/C5CY01512J",
      "volume": "6",
      "author": "Cicmil",
      "year": "2016",
      "journal-title": "Catal. Sci. Technol."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1150",
      "doi-asserted-by": "crossref",
      "first-page": "8855",
      "DOI": "10.1021/jacs.7b02179",
      "volume": "139",
      "author": "Delley",
      "year": "2017",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1155",
      "doi-asserted-by": "crossref",
      "first-page": "17064",
      "DOI": "10.1021/jacs.7b07437",
      "volume": "139",
      "author": "Barzan",
      "year": "2017",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1160",
      "doi-asserted-by": "crossref",
      "first-page": "1548",
      "DOI": "10.1107/S1600577515017786",
      "volume": "22",
      "author": "Mathon",
      "year": "2015",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1165",
      "unstructured": "M. Taramasso, G. Perego, B. Notari, Patent US Patent No. 4410501, (1983)."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1170",
      "doi-asserted-by": "crossref",
      "first-page": "497",
      "DOI": "10.1016/0021-9517(92)90176-I",
      "volume": "137",
      "author": "Millini",
      "year": "1992",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1175",
      "doi-asserted-by": "crossref",
      "first-page": "4125",
      "DOI": "10.1021/j100066a036",
      "volume": "98",
      "author": "Bordiga",
      "year": "1994",
      "journal-title": "J. Phys. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1180",
      "doi-asserted-by": "crossref",
      "first-page": "6382",
      "DOI": "10.1021/jp981225n",
      "volume": "102",
      "author": "Lamberti",
      "year": "1998",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1185",
      "doi-asserted-by": "crossref",
      "first-page": "220",
      "DOI": "10.1016/0021-9517(92)90199-R",
      "volume": "133",
      "author": "Bellussi",
      "year": "1992",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1190",
      "doi-asserted-by": "crossref",
      "first-page": "476",
      "DOI": "10.1006/jcat.1994.1085",
      "volume": "146",
      "author": "Maspero",
      "year": "1994",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1195",
      "doi-asserted-by": "crossref",
      "first-page": "163",
      "DOI": "10.1006/jcat.1995.1242",
      "volume": "156",
      "author": "Kumar",
      "year": "1995",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1200",
      "first-page": "253",
      "article-title": "Microporous crystalline titanium silicates",
      "volume": "Vol 41",
      "author": "Notari",
      "year": "1996"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1205",
      "doi-asserted-by": "crossref",
      "first-page": "10150",
      "DOI": "10.1021/ja7100399",
      "volume": "130",
      "author": "Fan",
      "year": "2008",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1210",
      "doi-asserted-by": "crossref",
      "first-page": "11156",
      "DOI": "10.1002/anie.201105678",
      "volume": "50",
      "author": "Chen",
      "year": "2011",
      "journal-title": "Angew. Chem.-Int. Ed."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1215",
      "doi-asserted-by": "crossref",
      "first-page": "1287",
      "DOI": "10.1021/acscatal.7b03558",
      "volume": "8",
      "author": "Lu",
      "year": "2018",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1220",
      "doi-asserted-by": "crossref",
      "first-page": "9021",
      "DOI": "10.1021/acs.jpcc.8b01401",
      "volume": "122",
      "author": "Signorile",
      "year": "2018",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1225",
      "doi-asserted-by": "crossref",
      "first-page": "5753",
      "DOI": "10.1021/la981420t",
      "volume": "15",
      "author": "Bolis",
      "year": "1999",
      "journal-title": "Langmuir"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1230",
      "doi-asserted-by": "crossref",
      "first-page": "67",
      "DOI": "10.1016/S1387-1811(99)00016-5",
      "volume": "30",
      "author": "Bolis",
      "year": "1999",
      "journal-title": "Microporous Mesoporous Mater."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1235",
      "doi-asserted-by": "crossref",
      "first-page": "101",
      "DOI": "10.1007/BF00808327",
      "volume": "34",
      "author": "Davis",
      "year": "1995",
      "journal-title": "Catal. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1240",
      "doi-asserted-by": "crossref",
      "first-page": "4812",
      "DOI": "10.1039/b005780k",
      "volume": "2",
      "author": "Gleeson",
      "year": "2000",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1245",
      "doi-asserted-by": "crossref",
      "first-page": "11409",
      "DOI": "10.1021/ja010607v",
      "volume": "123",
      "author": "Ricchiardi",
      "year": "2001",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1250",
      "doi-asserted-by": "crossref",
      "first-page": "9892",
      "DOI": "10.1021/jp026106t",
      "volume": "106",
      "author": "Bordiga",
      "year": "2002",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1255",
      "doi-asserted-by": "crossref",
      "first-page": "67",
      "DOI": "10.1023/A:1020504115146",
      "volume": "21",
      "author": "Zecchina",
      "year": "2002",
      "journal-title": "Top. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1260",
      "doi-asserted-by": "crossref",
      "first-page": "3573",
      "DOI": "10.1021/jp036166e",
      "volume": "108",
      "author": "Bonino",
      "year": "2004",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1265",
      "doi-asserted-by": "crossref",
      "first-page": "4854",
      "DOI": "10.1039/b706637f",
      "volume": "9",
      "author": "Bordiga",
      "year": "2007",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1270",
      "doi-asserted-by": "crossref",
      "first-page": "275",
      "DOI": "10.1016/j.ccr.2014.05.013",
      "volume": "277",
      "author": "van Bokhoven",
      "year": "2014",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1275",
      "doi-asserted-by": "crossref",
      "first-page": "20114",
      "DOI": "10.1021/acs.jpcc.6b05087",
      "volume": "120",
      "author": "Doug",
      "year": "2016",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1280",
      "doi-asserted-by": "crossref",
      "first-page": "19409",
      "DOI": "10.1039/c1cp21556f",
      "volume": "13",
      "author": "Gallo",
      "year": "2011",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1285",
      "doi-asserted-by": "crossref",
      "first-page": "79",
      "DOI": "10.1002/cphc.201200893",
      "volume": "14",
      "author": "Gallo",
      "year": "2013",
      "journal-title": "ChemPhysChem"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1290",
      "doi-asserted-by": "crossref",
      "first-page": "2220",
      "DOI": "10.1002/(SICI)1521-3773(19990802)38:15<2220::AID-ANIE2220>3.0.CO;2-G",
      "volume": "38",
      "author": "Li",
      "year": "1999",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1295",
      "doi-asserted-by": "crossref",
      "first-page": "2993",
      "DOI": "10.1021/jp0042359",
      "volume": "105",
      "author": "Li",
      "year": "2001",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1300",
      "doi-asserted-by": "crossref",
      "first-page": "4734",
      "DOI": "10.1002/anie.200290032",
      "volume": "41",
      "author": "Bordiga",
      "year": "2002",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1305",
      "doi-asserted-by": "crossref",
      "first-page": "4390",
      "DOI": "10.1039/b306041c",
      "volume": "5",
      "author": "Bordiga",
      "year": "2003",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1310",
      "doi-asserted-by": "crossref",
      "first-page": "13854",
      "DOI": "10.1002/chem.201201319",
      "volume": "18",
      "author": "Guo",
      "year": "2012",
      "journal-title": "Chem.-Eur. J."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1315",
      "doi-asserted-by": "crossref",
      "first-page": "2844",
      "DOI": "10.1021/jp310900a",
      "volume": "117",
      "author": "Guo",
      "year": "2013",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1320",
      "doi-asserted-by": "crossref",
      "first-page": "222",
      "DOI": "10.1006/jcat.1999.2403",
      "volume": "183",
      "author": "Lamberti",
      "year": "1999",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1325",
      "doi-asserted-by": "crossref",
      "first-page": "2",
      "DOI": "10.1107/S0108768199008927",
      "volume": "56",
      "author": "Artioli",
      "year": "2000",
      "journal-title": "Acta Crystallogr. Sect. B-Struct. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1330",
      "doi-asserted-by": "crossref",
      "first-page": "2204",
      "DOI": "10.1021/ja003657t",
      "volume": "123",
      "author": "Lamberti",
      "year": "2001",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1335",
      "doi-asserted-by": "crossref",
      "first-page": "12157",
      "DOI": "10.1021/jp002167k",
      "volume": "104",
      "author": "Hijar",
      "year": "2000",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1340",
      "doi-asserted-by": "crossref",
      "first-page": "7452",
      "DOI": "10.1021/jp0107715",
      "volume": "105",
      "author": "Henry",
      "year": "2001",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1345",
      "doi-asserted-by": "crossref",
      "first-page": "1612",
      "DOI": "10.1021/acs.jpcc.7b10104",
      "volume": "122",
      "author": "Signorile",
      "year": "2018",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1350",
      "doi-asserted-by": "crossref",
      "first-page": "85",
      "DOI": "10.1016/S1387-1811(00)00244-4",
      "volume": "40",
      "author": "Marra",
      "year": "2000",
      "journal-title": "Microporous Mesoporous Mater."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1355",
      "doi-asserted-by": "crossref",
      "first-page": "1287",
      "DOI": "10.1002/qua.24658",
      "volume": "114",
      "author": "Dovesi",
      "year": "2014",
      "journal-title": "Int. J. Quantum Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1360",
      "doi-asserted-by": "crossref",
      "first-page": "25260",
      "DOI": "10.1039/C5CP04189A",
      "volume": "17",
      "author": "Fischer",
      "year": "2015",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1365",
      "doi-asserted-by": "crossref",
      "first-page": "12274",
      "DOI": "10.1002/anie.201503476",
      "volume": "54",
      "author": "Wagner",
      "year": "2015",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1370",
      "doi-asserted-by": "crossref",
      "first-page": "15738",
      "DOI": "10.1039/C6CP02289H",
      "volume": "18",
      "author": "Fischer",
      "year": "2016",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1375",
      "doi-asserted-by": "crossref",
      "first-page": "2659",
      "DOI": "10.1002/jcc.24509",
      "volume": "37",
      "author": "Signorile",
      "year": "2016",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1380",
      "doi-asserted-by": "crossref",
      "first-page": "012043",
      "DOI": "10.1088/1742-6596/190/1/012043",
      "volume": "190",
      "author": "Di Cicco",
      "year": "2009",
      "journal-title": "Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1385",
      "doi-asserted-by": "crossref",
      "first-page": "196",
      "DOI": "10.1016/S0168-583X(02)01719-6",
      "volume": "200",
      "author": "Lamberti",
      "year": "2003",
      "journal-title": "Nucl. Instrum. Methods Phys. Res. Sect. B-Beam Interact. Mater. Atoms"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1390",
      "doi-asserted-by": "crossref",
      "first-page": "86",
      "DOI": "10.1126/science.1155200",
      "volume": "320",
      "author": "Teschner",
      "year": "2008",
      "journal-title": "Science"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1395",
      "doi-asserted-by": "crossref",
      "first-page": "119",
      "DOI": "10.1016/j.cattod.2016.02.065",
      "volume": "283",
      "author": "Bugaev",
      "year": "2017",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1400",
      "doi-asserted-by": "crossref",
      "first-page": "863",
      "DOI": "10.1016/0038-1098(93)90193-Q",
      "volume": "85",
      "author": "Soldatov",
      "year": "1993",
      "journal-title": "Solid State Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1405",
      "doi-asserted-by": "crossref",
      "first-page": "012028",
      "DOI": "10.1088/1742-6596/430/1/012028",
      "volume": "430",
      "author": "Bugaev",
      "year": "2013",
      "journal-title": "J. Phys. Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1410",
      "doi-asserted-by": "crossref",
      "first-page": "10416",
      "DOI": "10.1021/jp500734p",
      "volume": "118",
      "author": "Bugaev",
      "year": "2014",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1415",
      "doi-asserted-by": "crossref",
      "first-page": "1180",
      "DOI": "10.3103/S1062873815010098",
      "volume": "79",
      "author": "Bugaev",
      "year": "2015",
      "journal-title": "Bull. Russ. Acad. Sci: Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1420",
      "doi-asserted-by": "crossref",
      "first-page": "012032",
      "DOI": "10.1088/1742-6596/712/1/012032",
      "volume": "712",
      "author": "Bugaev",
      "year": "2016",
      "journal-title": "J. Phys. Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1425",
      "doi-asserted-by": "crossref",
      "first-page": "18202",
      "DOI": "10.1021/acs.jpcc.7b04152",
      "volume": "121",
      "author": "Bugaev",
      "year": "2017",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1430",
      "doi-asserted-by": "crossref",
      "first-page": "12029",
      "DOI": "10.1021/acs.jpcc.7b11473",
      "volume": "122",
      "author": "Bugaev",
      "year": "2018",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "journal-title": "Faraday Discuss.",
      "year": "2018",
      "author": "Bugaev",
      "key": "10.1016/j.cattod.2018.10.071_bib1435"
    },
    {
      "journal-title": "Faraday Discuss.",
      "year": "2018",
      "author": "Bugaev",
      "key": "10.1016/j.cattod.2018.10.071_bib1440"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1445",
      "doi-asserted-by": "crossref",
      "first-page": "19",
      "DOI": "10.1107/S0909049505038975",
      "volume": "13",
      "author": "Smolentsev",
      "year": "2006",
      "journal-title": "J. Synchrot. Radiat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1450",
      "doi-asserted-by": "crossref",
      "first-page": "569",
      "DOI": "10.1016/j.commatsci.2006.08.007",
      "volume": "39",
      "author": "Smolentsev",
      "year": "2007",
      "journal-title": "Comput. Mater. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1455",
      "doi-asserted-by": "crossref",
      "first-page": "8097",
      "DOI": "10.1039/C8CS00373D",
      "volume": "47",
      "author": "Borfecchia",
      "year": "2018",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1460",
      "doi-asserted-by": "crossref",
      "first-page": "800",
      "DOI": "10.1039/C0CC04218H",
      "volume": "47",
      "author": "Korhonen",
      "year": "2011",
      "journal-title": "Chem. Commun. (Camb.)"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1465",
      "doi-asserted-by": "crossref",
      "first-page": "4809",
      "DOI": "10.1021/jp212450d",
      "volume": "116",
      "author": "Deka",
      "year": "2012",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1470",
      "doi-asserted-by": "crossref",
      "first-page": "413",
      "DOI": "10.1021/cs300794s",
      "volume": "3",
      "author": "Deka",
      "year": "2013",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1475",
      "doi-asserted-by": "crossref",
      "first-page": "1639",
      "DOI": "10.1039/C3CP54132K",
      "volume": "16",
      "author": "Lezcano-Gonzalez",
      "year": "2014",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1480",
      "doi-asserted-by": "crossref",
      "first-page": "87",
      "DOI": "10.1016/j.jcat.2014.01.004",
      "volume": "312",
      "author": "Bates",
      "year": "2014",
      "journal-title": "J. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1485",
      "doi-asserted-by": "crossref",
      "first-page": "548",
      "DOI": "10.1039/C4SC02907K",
      "volume": "6",
      "author": "Borfecchia",
      "year": "2015",
      "journal-title": "Chem. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1490",
      "doi-asserted-by": "crossref",
      "first-page": "2832",
      "DOI": "10.1021/cs501673g",
      "volume": "5",
      "author": "Janssens",
      "year": "2015",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1495",
      "doi-asserted-by": "crossref",
      "first-page": "012041",
      "DOI": "10.1088/1742-6596/712/1/012041",
      "volume": "712",
      "author": "Lomachenko",
      "year": "2016",
      "journal-title": "J. Phys. Conf. Ser."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1500",
      "doi-asserted-by": "crossref",
      "first-page": "12025",
      "DOI": "10.1021/jacs.6b06809",
      "volume": "138",
      "author": "Lomachenko",
      "year": "2016",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1505",
      "doi-asserted-by": "crossref",
      "first-page": "6028",
      "DOI": "10.1021/jacs.6b02651",
      "volume": "138",
      "author": "Paolucci",
      "year": "2016",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1510",
      "doi-asserted-by": "crossref",
      "first-page": "898",
      "DOI": "10.1126/science.aan5630",
      "volume": "357",
      "author": "Paolucci",
      "year": "2017",
      "journal-title": "Science"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1515",
      "doi-asserted-by": "crossref",
      "first-page": "4447",
      "DOI": "10.1039/C4CC09645B",
      "volume": "51",
      "author": "Wulfers",
      "year": "2015",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1520",
      "doi-asserted-by": "crossref",
      "first-page": "424",
      "DOI": "10.1021/acscentsci.6b00139",
      "volume": "2",
      "author": "Narsimhan",
      "year": "2016",
      "journal-title": "ACS Cent. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1525",
      "doi-asserted-by": "crossref",
      "first-page": "14961",
      "DOI": "10.1021/jacs.7b06472",
      "volume": "139",
      "author": "Pappas",
      "year": "2017",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1530",
      "doi-asserted-by": "crossref",
      "first-page": "1396",
      "DOI": "10.1007/s11244-018-1036-9",
      "volume": "61",
      "author": "Martini",
      "year": "2018",
      "journal-title": "Top. Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1535",
      "doi-asserted-by": "crossref",
      "first-page": "344",
      "DOI": "10.1021/jp9601577",
      "volume": "101",
      "author": "Lamberti",
      "year": "1997",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1540",
      "doi-asserted-by": "crossref",
      "first-page": "4064",
      "DOI": "10.1021/jp993893u",
      "volume": "104",
      "author": "Palomino",
      "year": "2000",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1545",
      "doi-asserted-by": "crossref",
      "first-page": "7036",
      "DOI": "10.1021/jp0275847",
      "volume": "107",
      "author": "Llabr\u00e9s i Xamena",
      "year": "2003",
      "journal-title": "J. Phys. Chem. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1550",
      "doi-asserted-by": "crossref",
      "first-page": "12741",
      "DOI": "10.1039/c3dt50732g",
      "volume": "42",
      "author": "Giordanino",
      "year": "2013",
      "journal-title": "Dalton Trans."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1555",
      "doi-asserted-by": "crossref",
      "first-page": "17",
      "DOI": "10.1016/j.elspec.2012.09.004",
      "volume": "188",
      "author": "Glatzel",
      "year": "2013",
      "journal-title": "J. Electron Spectrosc. Relat. Phenom."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1560",
      "doi-asserted-by": "crossref",
      "first-page": "4291",
      "DOI": "10.1021/acscatal.6b03005",
      "volume": "7",
      "author": "Ipek",
      "year": "2017",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1565",
      "doi-asserted-by": "crossref",
      "first-page": "15270",
      "DOI": "10.1021/jacs.8b08071",
      "volume": "149",
      "author": "Pappas",
      "year": "2018",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1570",
      "doi-asserted-by": "crossref",
      "first-page": "191",
      "DOI": "10.1039/B618320B",
      "volume": "37",
      "author": "Ferey",
      "year": "2008",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1575",
      "doi-asserted-by": "crossref",
      "first-page": "1400",
      "DOI": "10.1039/b807086p",
      "volume": "38",
      "author": "Perry",
      "year": "2009",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1580",
      "doi-asserted-by": "crossref",
      "first-page": "1700",
      "DOI": "10.1021/cm1022882",
      "volume": "23",
      "author": "Valenzano",
      "year": "2011",
      "journal-title": "Chem. Mat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1585",
      "doi-asserted-by": "crossref",
      "first-page": "675",
      "DOI": "10.1021/cr200205j",
      "volume": "112",
      "author": "O\u2019Keeffe",
      "year": "2012",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1590",
      "doi-asserted-by": "crossref",
      "first-page": "933",
      "DOI": "10.1021/cr200304e",
      "volume": "112",
      "author": "Stock",
      "year": "2012",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1595",
      "doi-asserted-by": "crossref",
      "first-page": "734",
      "DOI": "10.1021/cr3002824",
      "volume": "113",
      "author": "Cook",
      "year": "2013",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1600",
      "doi-asserted-by": "crossref",
      "first-page": "5561",
      "DOI": "10.1039/C4CS00003J",
      "volume": "43",
      "author": "Lu",
      "year": "2014",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1605",
      "doi-asserted-by": "crossref",
      "first-page": "280",
      "DOI": "10.1070/RCR4554",
      "volume": "85",
      "author": "Butova",
      "year": "2016",
      "journal-title": "Russ. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1610",
      "doi-asserted-by": "crossref",
      "first-page": "12466",
      "DOI": "10.1021/acs.chemrev.6b00346",
      "volume": "116",
      "author": "Schoedel",
      "year": "2016",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1615",
      "doi-asserted-by": "crossref",
      "first-page": "1284",
      "DOI": "10.1039/b804680h",
      "volume": "38",
      "author": "Czaja",
      "year": "2009",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1620",
      "doi-asserted-by": "crossref",
      "first-page": "9376",
      "DOI": "10.1021/ja0523082",
      "volume": "127",
      "author": "Dinca",
      "year": "2005",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1625",
      "doi-asserted-by": "crossref",
      "first-page": "5125",
      "DOI": "10.1039/b810574j",
      "author": "Dietzel",
      "year": "2008",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1630",
      "doi-asserted-by": "crossref",
      "first-page": "8386",
      "DOI": "10.1021/ja8007159",
      "volume": "130",
      "author": "Vitillo",
      "year": "2008",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1635",
      "doi-asserted-by": "crossref",
      "first-page": "1294",
      "DOI": "10.1039/b802256a",
      "volume": "38",
      "author": "Murray",
      "year": "2009",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1640",
      "doi-asserted-by": "crossref",
      "first-page": "782",
      "DOI": "10.1021/cr200274s",
      "volume": "112",
      "author": "Suh",
      "year": "2012",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1645",
      "doi-asserted-by": "crossref",
      "first-page": "9755",
      "DOI": "10.1021/acs.chemrev.7b00095",
      "volume": "117",
      "author": "Shah",
      "year": "2017",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1650",
      "doi-asserted-by": "crossref",
      "first-page": "1450",
      "DOI": "10.1021/acs.cgd.7b00166",
      "volume": "17",
      "author": "Yang",
      "year": "2017",
      "journal-title": "Cryst. Growth Des."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1655",
      "doi-asserted-by": "crossref",
      "first-page": "108",
      "DOI": "10.1016/j.mattod.2017.07.006",
      "volume": "21",
      "author": "Li",
      "year": "2018",
      "journal-title": "Mater. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1660",
      "doi-asserted-by": "crossref",
      "first-page": "1450",
      "DOI": "10.1039/b807080f",
      "volume": "38",
      "author": "Lee",
      "year": "2009",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1665",
      "doi-asserted-by": "crossref",
      "first-page": "7502",
      "DOI": "10.1002/anie.200806063",
      "volume": "48",
      "author": "Farrusseng",
      "year": "2009",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1670",
      "doi-asserted-by": "crossref",
      "first-page": "1248",
      "DOI": "10.1039/b807083k",
      "volume": "38",
      "author": "Ma",
      "year": "2009",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1675",
      "doi-asserted-by": "crossref",
      "first-page": "4606",
      "DOI": "10.1021/cr9003924",
      "volume": "110",
      "author": "Corma",
      "year": "2010",
      "journal-title": "Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1680",
      "doi-asserted-by": "crossref",
      "first-page": "1196",
      "DOI": "10.1021/cr2003147",
      "volume": "112",
      "author": "Yoon",
      "year": "2012",
      "journal-title": "Chem. Rev."
    },
    {
      "year": "2013",
      "series-title": "Metal Organic Frameworks As Heterogeneous Catalysts",
      "author": "Llabr\u00e9s i Xamena",
      "key": "10.1016/j.cattod.2018.10.071_bib1685"
    },
    {
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      "first-page": "590",
      "DOI": "10.1038/nchem.1956",
      "volume": "6",
      "author": "Xiao",
      "year": "2014",
      "journal-title": "Nat. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1695",
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      "first-page": "6011",
      "DOI": "10.1039/C4CS00094C",
      "volume": "43",
      "author": "Liu",
      "year": "2014",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1700",
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      "first-page": "181",
      "DOI": "10.1016/j.ccr.2016.03.003",
      "volume": "320",
      "author": "Zhan",
      "year": "2016",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1705",
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      "first-page": "126",
      "DOI": "10.1039/C6CS00250A",
      "volume": "46",
      "author": "Huang",
      "year": "2017",
      "journal-title": "Chem. Soc. Rev."
    },
    {
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      "first-page": "80",
      "DOI": "10.1016/j.ccr.2017.02.010",
      "volume": "337",
      "author": "Zhao",
      "year": "2017",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1715",
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      "first-page": "1",
      "DOI": "10.1016/j.ccr.2018.02.008",
      "volume": "362",
      "author": "Chen",
      "year": "2018",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1720",
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      "first-page": "105",
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      "volume": "357",
      "author": "Kempahanumakkagari",
      "year": "2018",
      "journal-title": "Coord. Chem. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1725",
      "doi-asserted-by": "crossref",
      "first-page": "5268",
      "DOI": "10.1039/C8CC00789F",
      "volume": "54",
      "author": "Zhang",
      "year": "2018",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1730",
      "doi-asserted-by": "crossref",
      "first-page": "2630",
      "DOI": "10.1021/cs3005874",
      "volume": "2",
      "author": "Wang",
      "year": "2012",
      "journal-title": "ACS Catal."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1735",
      "doi-asserted-by": "crossref",
      "first-page": "3364",
      "DOI": "10.1002/anie.201108357",
      "volume": "51",
      "author": "Fu",
      "year": "2012",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1740",
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      "first-page": "7440",
      "DOI": "10.1002/anie.201202471",
      "volume": "51",
      "author": "Fateeva",
      "year": "2012",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1745",
      "doi-asserted-by": "crossref",
      "first-page": "5414",
      "DOI": "10.1002/anie.201505581",
      "volume": "55",
      "author": "Dhakshinamoorthy",
      "year": "2016",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1750",
      "doi-asserted-by": "crossref",
      "first-page": "9156",
      "DOI": "10.1021/ic301280n",
      "volume": "51",
      "author": "Chen",
      "year": "2012",
      "journal-title": "Inorg. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1755",
      "doi-asserted-by": "crossref",
      "first-page": "982",
      "DOI": "10.1002/cplu.201200186",
      "volume": "77",
      "author": "Shih",
      "year": "2012",
      "journal-title": "ChemPlusChem"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1760",
      "doi-asserted-by": "crossref",
      "first-page": "1199",
      "DOI": "10.1021/ar400265x",
      "volume": "47",
      "author": "Zhao",
      "year": "2014",
      "journal-title": "Acc. Chem. Res."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1765",
      "doi-asserted-by": "crossref",
      "first-page": "1938",
      "DOI": "10.1039/C4SC03367A",
      "volume": "6",
      "author": "Huo",
      "year": "2015",
      "journal-title": "Chem. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1770",
      "doi-asserted-by": "crossref",
      "first-page": "4276",
      "DOI": "10.1021/ja513058h",
      "volume": "137",
      "author": "Shieh",
      "year": "2015",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1775",
      "doi-asserted-by": "crossref",
      "first-page": "6804",
      "DOI": "10.1039/C4CS00395K",
      "volume": "44",
      "author": "Chughtai",
      "year": "2015",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1780",
      "doi-asserted-by": "crossref",
      "first-page": "3386",
      "DOI": "10.1039/C7CS00058H",
      "volume": "46",
      "author": "Lian",
      "year": "2017",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1785",
      "doi-asserted-by": "crossref",
      "first-page": "4192",
      "DOI": "10.1039/C7NJ03619A",
      "volume": "42",
      "author": "Samui",
      "year": "2018",
      "journal-title": "New J. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1790",
      "doi-asserted-by": "crossref",
      "first-page": "6354",
      "DOI": "10.1002/anie.200501508",
      "volume": "44",
      "author": "Dietzel",
      "year": "2005",
      "journal-title": "Angew. Chem.-Int. Ed."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1795",
      "doi-asserted-by": "crossref",
      "first-page": "959",
      "DOI": "10.1039/b515434k",
      "author": "Dietzel",
      "year": "2006",
      "journal-title": "Chem. Commun."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1800",
      "doi-asserted-by": "crossref",
      "first-page": "15268",
      "DOI": "10.1021/ja807023q",
      "volume": "130",
      "author": "Zhou",
      "year": "2008",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1805",
      "doi-asserted-by": "crossref",
      "first-page": "12586",
      "DOI": "10.1039/c3dt51312b",
      "volume": "42",
      "author": "Chavan",
      "year": "2013",
      "journal-title": "Dalton Trans."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1810",
      "unstructured": "M.T. Kapelewski, S.J. Geier, M.R. Hudson, D. St\u00fcck, J.A. Mason, J.N. Nelson, D.J. Xiao, Z. Hulvey, E. Gilmour, S.A. FitzGerald, M. Head-Gordon, C.M. Brown, J.R. Long, 136 (2014) 12119-12129."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1815",
      "doi-asserted-by": "crossref",
      "first-page": "7362",
      "DOI": "10.1039/b911242a",
      "volume": "19",
      "author": "Dietzel",
      "year": "2009",
      "journal-title": "J. Mater. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1820",
      "doi-asserted-by": "crossref",
      "first-page": "11887",
      "DOI": "10.1021/ja4045289",
      "volume": "135",
      "author": "Peng",
      "year": "2013",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1825",
      "doi-asserted-by": "crossref",
      "first-page": "9811",
      "DOI": "10.1039/b907258f",
      "volume": "11",
      "author": "Chavan",
      "year": "2009",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1830",
      "doi-asserted-by": "crossref",
      "first-page": "10870",
      "DOI": "10.1021/ja8036096",
      "volume": "130",
      "author": "Caskey",
      "year": "2008",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1835",
      "doi-asserted-by": "crossref",
      "first-page": "4569",
      "DOI": "10.1039/C4SC02064B",
      "volume": "5",
      "author": "Queen",
      "year": "2014",
      "journal-title": "Chem. Sci."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1840",
      "doi-asserted-by": "crossref",
      "first-page": "21777",
      "DOI": "10.1021/jp205869k",
      "volume": "115",
      "author": "Valenzano",
      "year": "2011",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1845",
      "doi-asserted-by": "crossref",
      "first-page": "3292",
      "DOI": "10.1021/jp809872w",
      "volume": "113",
      "author": "Chavan",
      "year": "2009",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1850",
      "doi-asserted-by": "crossref",
      "first-page": "10752",
      "DOI": "10.1021/ja505318p",
      "volume": "136",
      "author": "Bloch",
      "year": "2014",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1855",
      "doi-asserted-by": "crossref",
      "first-page": "4957",
      "DOI": "10.1021/cm800686k",
      "volume": "20",
      "author": "Bonino",
      "year": "2008",
      "journal-title": "Chem. Mat."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1860",
      "doi-asserted-by": "crossref",
      "first-page": "67",
      "DOI": "10.1016/j.cattod.2011.07.020",
      "volume": "182",
      "author": "Valenzano",
      "year": "2012",
      "journal-title": "Catal. Today"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1865",
      "doi-asserted-by": "crossref",
      "first-page": "14814",
      "DOI": "10.1021/ja205976v",
      "volume": "133",
      "author": "Bloch",
      "year": "2011",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1870",
      "doi-asserted-by": "crossref",
      "first-page": "15615",
      "DOI": "10.1021/jp402440u",
      "volume": "117",
      "author": "Chavan",
      "year": "2013",
      "journal-title": "J. Phys. Chem. C"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1875",
      "doi-asserted-by": "crossref",
      "first-page": "10759",
      "DOI": "10.1039/C5CP01063B",
      "volume": "17",
      "author": "Van de Voorde",
      "year": "2015",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1880",
      "doi-asserted-by": "crossref",
      "first-page": "11169",
      "DOI": "10.1103/PhysRevB.54.11169",
      "volume": "54",
      "author": "Kresse",
      "year": "1996",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1885",
      "doi-asserted-by": "crossref",
      "first-page": "1758",
      "DOI": "10.1103/PhysRevB.59.1758",
      "volume": "59",
      "author": "Kresse",
      "year": "1999",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1890",
      "doi-asserted-by": "crossref",
      "first-page": "2044",
      "DOI": "10.1002/jcc.21057",
      "volume": "29",
      "author": "Hafner",
      "year": "2008",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1895",
      "doi-asserted-by": "crossref",
      "first-page": "3865",
      "DOI": "10.1103/PhysRevLett.77.3865",
      "volume": "77",
      "author": "Perdew",
      "year": "1996",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1900",
      "doi-asserted-by": "crossref",
      "first-page": "15618",
      "DOI": "10.1021/ja045561v",
      "volume": "126",
      "author": "Hayakawa",
      "year": "2004",
      "journal-title": "J. Am. Chem. Soc."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1905",
      "first-page": "57",
      "article-title": "Bond length determination using XANES",
      "volume": "Vol 27",
      "author": "Bianconi",
      "year": "1983"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1910",
      "first-page": "38",
      "article-title": "Distance dependence of continuum and bound state of excitonic resonances in X-ray absorption near edge structure (XANES)",
      "volume": "Vol 2",
      "author": "Natoli",
      "year": "1984"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1915",
      "doi-asserted-by": "crossref",
      "first-page": "1",
      "DOI": "10.1016/S0167-5729(97)00011-3",
      "volume": "30",
      "author": "Chen",
      "year": "1997",
      "journal-title": "Surf. Sci. Rep."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1920",
      "doi-asserted-by": "crossref",
      "first-page": "1244",
      "DOI": "10.1039/B509853J",
      "volume": "35",
      "author": "Hahner",
      "year": "2006",
      "journal-title": "Chem. Soc. Rev."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1925",
      "doi-asserted-by": "crossref",
      "first-page": "281",
      "DOI": "10.1038/nmat2399",
      "volume": "8",
      "author": "Ade",
      "year": "2009",
      "journal-title": "Nat. Mater."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1930",
      "doi-asserted-by": "crossref",
      "first-page": "1459",
      "DOI": "10.1002/pssb.200945067",
      "volume": "246",
      "author": "Havecker",
      "year": "2009",
      "journal-title": "Phys. Status Solidi B-Basic Solid State Phys."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1935",
      "doi-asserted-by": "crossref",
      "first-page": "083003",
      "DOI": "10.1088/0953-8984/27/8/083003",
      "volume": "27",
      "author": "Toyoshima",
      "year": "2015",
      "journal-title": "J. Phys.-Condes. Matter"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1940",
      "doi-asserted-by": "crossref",
      "first-page": "10116",
      "DOI": "10.1002/anie.201008214",
      "volume": "50",
      "author": "Somorjai",
      "year": "2011",
      "journal-title": "Angew. Chem.-Int. Edit."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1945",
      "doi-asserted-by": "crossref",
      "first-page": "054101",
      "DOI": "10.1063/1.5019333",
      "volume": "89",
      "author": "Castan-Guerrero",
      "year": "2018",
      "journal-title": "Rev. Sci. Instrum."
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1950",
      "doi-asserted-by": "crossref",
      "first-page": "3604",
      "DOI": "10.1021/acs.langmuir.8b00028",
      "volume": "34",
      "author": "Borgatti",
      "year": "2018",
      "journal-title": "Langmuir"
    },
    {
      "key": "10.1016/j.cattod.2018.10.071_bib1955",
      "series-title": "X-Ray Absorption and X-Ray Emission Spectroscopy: Theory and Applications",
      "first-page": "125",
      "article-title": "Hard X-ray photon-in/photon-out spectroscopy: instrumentation, theory and applications",
      "author": "Glatzel",
      "year": "2016"
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