Crossref journal-article
American Chemical Society (ACS)
Journal of Chemical Theory and Computation (316)
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Voloshina, E., & Paulus, B. (2014). First Multireference Correlation Treatment of Bulk Metals. Journal of Chemical Theory and Computation, 10(4), 1698–1706.

Authors 2
  1. Elena Voloshina (first)
  2. Beate Paulus (additional)
References 62 Referenced 30
  1. {'key': 'ref1/cit1a', 'volume-title': 'Lect. N. Chem. 67', 'author': 'Pisani C.', 'year': '1996'} / Lect. N. Chem. 67 by Pisani C. (1996)
  2. 10.1002/0471720895.ch1 / Rev. Comput. Chem. by Dovesi R. (2005)
  3. cCRYSTAL Homepage.http://www.crystal.unito.it(accessed Jan. 20, 2014) .
  4. 10.1039/b803274m / Phys. Chem. Chem. Phys. by Izmaylov A. F. (2008)
  5. 10.1063/1.1857479 / J. Chem. Phys. by Pisani C. (2005)
  6. bCRYSCOR.http://www.cryscor.unito.it(accessed Jan 20, 2014) .
  7. 10.1063/1.3126249 / J. Chem. Phys. by Marsman M. (2009)
  8. 10.1038/nature11770 / Nature by Booth G. H. (2013)
  9. 10.1039/b007869g / Phys. Chem. Chem. Phys. by Köhn A. (2001)
  10. 10.1039/b613676a / Phys. Chem. Chem. Phys. by Manby F. R. (2006)
  11. 10.1039/B608262A / Phys. Chem. Chem. Phys. by Tuma C. (2006)
  12. 10.1103/PhysRevLett.98.176103 / Phys. Rev. Lett. by Hu Q.-M. (2007)
  13. Erratum: 2007, 99, 169903. (10.1002/j.1551-8833.2007.tb07988.x)
  14. 10.1021/jp900955h / J. Phys. Chem. A by Stoll H. (2009)
  15. 10.1063/1.3021077 / J. Chem. Phys. by Hirata S. (2008)
  16. 10.1063/1.2052708 / J. Chem. Phys. by Stoll H. (2005)
  17. 10.1016/0009-2614(92)85587-Z / Chem. Phys. Lett. by Stoll H. (1992)
  18. 10.1063/1.463415 / J. Chem. Phys. by Stoll H. (1992)
  19. 10.1103/PhysRevB.46.6700 / Phys. Rev. B by Stoll H. (1992)
  20. 10.1080/00268970903313675 / Mol. Phys. by Stoll H. (2010)
  21. 10.1016/j.physrep.2006.01.003 / Phys. Rep. by Paulus B. (2006)
  22. 10.1002/jcc.20991 / J. Comput. Chem. by Voloshina E. (2008)
  23. 10.1063/1.2206187 / J. Chem. Phys. by Voloshina E. (2006)
  24. 10.1016/j.chemphys.2009.06.007 / Chem. Phys. by Müller C. (2009)
  25. 10.1016/j.susc.2009.06.014 / Surf. Sci. by Müller C. (2009)
  26. 10.1021/ct300938w / J. Chem. Theory Comput. by Friedrich J. (2013)
  27. 10.1063/1.3394017 / J. Chem. Phys. by Friedrich J. (2010)
  28. 10.1524/zpch.2010.6121 / Z. Phys. Chem. by Friedrich J. (2010)
  29. 10.1063/1.3522881 / J. Chem. Phys. by Mata R. A. (2011)
  30. 10.1039/c1cp20609e / Phys. Chem. Chem. Phys. by Voloshina E. (2011)
  31. 10.1103/PhysRevB.83.245136 / Phys. Rev. B by Müller C. (2011)
  32. 10.1039/c2cp24020c / Phys. Chem. Chem. Phys. by Müller C. (2012)
  33. 10.1039/b812898g / Chem. Modell. by Voloshina E. (2009)
  34. 10.1524/zpch.2010.6111 / Z. Phys. Chem. by Voloshina E. (2010)
  35. 10.1103/PhysRevB.75.245117 / Phys. Rev. B by Voloshina E. (2007)
  36. 10.1080/00268970701704794 / Mol. Phys. by Voloshina E. (2007)
  37. 10.1103/PhysRevB.85.045444 / Phys. Rev. B by Voloshina E. (2012)
  38. 10.1103/PhysRevB.76.214116 / Phys. Rev. B by Gaston N. (2007)
  39. 10.1103/PhysRevLett.100.226404 / Phys. Rev. Lett. by Gaston N. (2008)
  40. 10.1039/B915967C / Phys. Chem. Chem. Phys. by Gaston N. (2010)
  41. 10.1103/PhysRevB.70.165106 / Phys. Rev. B by Paulus B. (2004)
  42. 10.1103/PhysRevB.74.094102 / Phys. Rev. B by Gaston N. (2006)
  43. 10.1016/S0009-2614(03)00082-4 / Chem. Phys. Lett. by Paulus B. (2003)
  44. 10.1016/j.cplett.2008.12.042 / Chem. Phys. Lett. by Stoll H. (2009)
  45. {'key': 'ref28/cit28', 'first-page': '275504', 'volume': '22', 'author': 'Belger D.', 'year': '2010', 'journal-title': 'J. Phys.: Condens. Matter'} / J. Phys.: Condens. Matter by Belger D. (2010)
  46. 10.1063/1.2715555 / J. Chem. Phys. by Voloshina E. (2007)
  47. 10.1063/1.465823 / J. Chem. Phys. by Heilingbrunner A. (1993)
  48. {'key': 'ref31/cit31', 'first-page': '35', 'volume': '14', 'author': 'Cizek J.', 'year': '1969', 'journal-title': 'Adv. Chem. Phys.'} / Adv. Chem. Phys. by Cizek J. (1969)
  49. 10.1002/qua.560080106 / Int. J. Quantum Chem. by Langhoff S. R. (1974)
  50. 10.1002/qua.560110112 / Int. J. Quantum Chem. by Pople J. A. (1977)
  51. 10.1016/0009-2614(88)87388-3 / Chem. Phys. Lett. by Gdanitz R. J. (1988)
  52. 10.1007/BF01112867 / Theor. Chim. Acta by Werner H. J. (1990)
  53. 10.1002/wcms.82 / WIREs Comput. Mol. Sci. by Werner H.-J. (2012)
  54. bWerner, H.J.; Knowles, P. J.; Knizia, G.; Manby, F. R.; Schütz, M.; Celani, P.; Korona, T.; Lindh, R.; Mitrushenkov, A.; Rauhut, G.; Shamasundar, K. R.; Adler, T. B.; Amos, R. D.; Bernhardsson, A.; Berning, A.; Cooper, D. L.; Deegan, M. J. O.; Dobbyn, A. J.; Eckert, F.; Goll, E.; Hampel, C.; Hesselmann, A.; Hetzer, G.; Hrenar, T.; Jansen, G.; Köppl, C.; Liu, Y.; Lloyd, A. W.; Mata, R. A.; May, A. J.; McNicholas, S. J.; Meyer, W.; Mura, M. E.; Nicklass, A.; O’Neill, D. P.; Palmieri, P.; Peng, D.; Pflüger, K.; Pitzer, R.; Reiher, M.; Shiozaki, T.; Stoll, H.; Stone, A. J.; Tarroni, R.; Thorsteinsson, T.; Wang, M.MOLPRO, version 2012.1;Institut für Theoretische Chemie, Universität Stuttgart:Stuttgart, Germany, 2012.
  55. chttp://www.molpro.net(accessed Jan 20, 2014) .
  56. {'key': 'ref37/cit37', 'first-page': '012029', 'volume': '117', 'author': 'Voloshina E.', 'year': '2008', 'journal-title': 'J. Phys.: Conf. Series'} / J. Phys.: Conf. Series by Voloshina E. (2008)
  57. 10.1063/1.459993 / J. Chem. Phys. by Kaupp M. (1991)
  58. 10.1088/0022-3700/18/7/010 / J. Phys. B by Fuentealba P. (1985)
  59. Kittel, C.Introduction to Solid State Physics,8th ed.Wiley:New York, 2005; p50.
  60. 10.1080/00268977000101561 / Mol. Phys. by Boys S. (1970)
  61. 10.1103/PhysRevLett.110.226401 / Phys. Rev. Lett. by Shepherd J. J. (2013)
  62. 10.1103/PhysRevB.86.035111 / Phys. Rev. B by Shepherd J. J. (2012)
Dates
Type When
Created 11 years, 6 months ago (Feb. 21, 2014, 4:46 p.m.)
Deposited 1 year, 3 months ago (May 24, 2024, 9:18 a.m.)
Indexed 1 year, 3 months ago (May 24, 2024, 9:40 a.m.)
Issued 11 years, 5 months ago (March 6, 2014)
Published 11 years, 5 months ago (March 6, 2014)
Published Online 11 years, 5 months ago (March 6, 2014)
Published Print 11 years, 4 months ago (April 8, 2014)
Funders 0

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@article{Voloshina_2014, title={First Multireference Correlation Treatment of Bulk Metals}, volume={10}, ISSN={1549-9626}, url={http://dx.doi.org/10.1021/ct401040t}, DOI={10.1021/ct401040t}, number={4}, journal={Journal of Chemical Theory and Computation}, publisher={American Chemical Society (ACS)}, author={Voloshina, Elena and Paulus, Beate}, year={2014}, month=mar, pages={1698–1706} }