DOI: 10.1016/s0016-7037(03)00237-0. Surface complexation of arsenic(V) to iron(III) (hydr)oxides: structural mechanism from ab initio molecular geometries and EXAFS spectroscopy

Surface complexation of arsenic(V) to iron(III) (hydr)oxides: structural mechanism from ab initio molecular geometries and EXAFS spectroscopy

10.1016/s0016-7037(03)00237-0

Crossref journal-article

Elsevier BV

Geochimica et Cosmochimica Acta (78)

Bibliography

Sherman, D. M., & Randall, S. R. (2003). Surface complexation of arsenic(V) to iron(III) (hydr)oxides: structural mechanism from ab initio molecular geometries and EXAFS spectroscopy. Geochimica et Cosmochimica Acta, 67(22), 4223â4230.

Authors 2

David M Sherman (first)
Simon R Randall (additional)

References 34 Referenced 624

10.1021/es00144a013 / Environ. Sci. Technol. / Insight into the mechanism of accumulation of arsenate and phosphate in hydro lake sediments by measuring the rate of dissolution with ethylenediamine-tetraacetic acid by Aggett (1986)
10.1016/0016-7037(90)90198-T / Geochim. Cosmochim. Acta / Interactions between arsenic and iron oxyhydroxides in lacustrine sediments by Belzile (1990)
Binsted N (1998) EXCURV98: CCLRC Daresbury Laboratory computer program. Daresbury Laboratory, Warrington, U.K
10.1016/S0927-7757(00)00712-3 / Colloids and Surfaces A / Modeling proton binding at the goethite (α-FeOOH)-water interface by Boily (2001)
10.1021/es0110271 / Env. Sci. Technol. / Scavenging of as from acid mine drainage by schwertmannite and ferrihydrite by Carlson (2002)
{'key': '10.1016/S0016-7037(03)00237-0_BIB6', 'series-title': 'A Guide to EXBACK, EXCALIB, and EXCURV92', 'author': 'Dent', 'year': '1992'} / A Guide to EXBACK, EXCALIB, and EXCURV92 by Dent (1992)
10.1021/es010216g / Env. Sci. Tech. / Mechanisms of arsenic uptake from aqueous solution by interaction with goethite, lepidocrocite, mackinawite, and pyrite by Farquhar (2002)
10.1021/es950653t / Envrion. Sci. Technol. / Arsenate and chromate retention mechanisms on goethite. 1. Surface structure by Fendorf (1997)
10.2138/am-1998-5-616 / American Mineralogist / Quantitative speciation of arsenic in mine tailings using X-ray absorption spectroscopy by Foster (1998)
10.1016/0016-7061(95)00023-H / Geoderma / Evaluation for contaminant ion adsorption-desorption on goethite using pressure-jump relaxation kinetics by Grossl (1995)
10.1021/es950654l / Envrion. Sci. Technol. / Arsenate and chromate retention mechanisms on goethite. 2. Kinetic evaluation using a pressure-jump relaxation technique by Grossl (1997)
10.1088/0022-3719/19/11/021 / J. Phys. C: Solid State Phys / Multiple scattering rapid curved wave theory by Gurman (1986)
{'key': '10.1016/S0016-7037(03)00237-0_BIB13', 'first-page': '1', 'article-title': 'Effects of electron-electron and electron-phonon interactions on the one-electron states of solids', 'volume': '23', 'author': 'Hedin', 'year': '1969', 'journal-title': 'Solid State Phys'} / Solid State Phys / Effects of electron-electron and electron-phonon interactions on the one-electron states of solids by Hedin (1969)
10.1016/0927-7757(94)02752-8 / Colloids Surfaces A - Physicochem. Eng. Aspects / Characterization of arsenate adsorption on hydrous iron oxide using chemical and physical methods by Hsia (1994)
10.1021/es980722e / Env. Sci. Technol. / Arsenite and arsenate adsorption on ferrihydrite by Jain (1999)
10.1107/S056774087500266X / Acta Crysta / Refinement of the crystal structure of scorodite by Kitahama (1975)
Kurchhof A., Pebler A., and Warkensten, eds. (1991) Inorganic crystal structure database (ICSD). Gmelin-Institute fur Anorganische Chemie
10.1016/S0016-7037(00)00581-0 / Geochim. Cosmochim. Acta / Mechanism of anion retention from EXAFS and density functional calculations by Ladeira (2001)
10.1097/00010694-198102000-00004 / Soil Sci / Adsorption of arsenate by soils and its relation to selected chemical-properties and anions by Livesey (1981)
10.1016/0016-7037(95)00275-5 / Geochim. Cosmochim. Acta / The mechanism of anion adsorption on iron oxides by Manceau (1995)
10.1103/PhysRevB.50.15509 / Phys. Rev. B / Multiple-scattering effects in x-ray absorption fine structure by Pandya (1994)
10.1103/PhysRevB.46.6671 / Phys. Rev. / Atoms, molecules, solids, and surfaces - applications of the generalized gradient approximation for exchange and correlation by Perdew (1992)
10.1021/es980949+ / Environmental Science and Technology / Natural input of arsenic into a coral reef ecosystem by hydrothermal fluids and its removal by Fe(III) oxyhydroxides by Pichler (1999)
10.1016/S0016-7037(99)00263-X / Geochim. Cosmochim. Acta / The mechanism of cadmium surface complexation on iron oxyhydroxide minerals by Randall (1999)
Schwertmann U. and Cornell R. M. (1991) Iron oxides in the Laboratory: Preparation and Characterization. VCH Publishers. Weinheim
10.1007/BF00308210 / Phys. Chem. Mineral. / Electronic structures of Fe3+ coordination sites in iron oxides by Sherman (1985)
10.1016/0016-7037(96)00040-3 / Geochim. Cosmochim. Acta / Diagenetic cycling of arsenic in Amazon shelf sediments by Sullivan (1996)
10.1097/00010694-199612000-00006 / Soil Science / An investigation of arsenate and arsenite bonding structures on goethite by FTIR by Sun (1996)
10.1002/jcc.1056 / Journal of Computational Chemistry / Chemistry with ADF by te Velde (2001)
10.1139/p80-159 / Can. J. Phys. / Accurate spin-dependent electron liquid correlation energy for local spin density calculations by Vosko (1980)
10.1016/0016-7037(93)90567-G / Geochim. Cosmochim. Acta / Surface chemistry of ferrihydrite. 1. EXAFS studies of the geometry of coprecipitated and adsorbed arsenate by Waychunas (1993)
10.1016/0016-7037(95)00276-6 / Geochim. Cosmochim. Acta / Geometry of sorbed arsenate on ferrihydrite and crystalline FeOOH by Waychunas (1995)
10.1016/0016-7037(96)89830-9 / Geochim. Cosmochim. Acta / Wide angle X-ray scattering (WAXS) of “two-line” ferrihydrite structure by Waychunas (1996)
10.1016/0927-7757(95)03368-8 / Colloids and Surfaces A - Physicochem. Eng. Aspects / Adsorption of arsenic onto hydrous ferric oxide - effects of adsorbate/adsorbent ratios and co-occurring solute by Wilkie (1996)

Dates

Type	When
Created	21 years, 9 months ago (Nov. 6, 2003, 11:08 a.m.)
Deposited	6 years, 6 months ago (Feb. 17, 2019, 4:55 a.m.)
Indexed	3 days, 7 hours ago (Aug. 23, 2025, 9:43 p.m.)
Issued	21 years, 9 months ago (Nov. 1, 2003)
Published	21 years, 9 months ago (Nov. 1, 2003)
Published Print	21 years, 9 months ago (Nov. 1, 2003)

Funders 0

None

BibTeX

@article{Sherman_2003, title={Surface complexation of arsenic(V) to iron(III) (hydr)oxides: structural mechanism from ab initio molecular geometries and EXAFS spectroscopy}, volume={67}, ISSN={0016-7037}, url={http://dx.doi.org/10.1016/s0016-7037(03)00237-0}, DOI={10.1016/s0016-7037(03)00237-0}, number={22}, journal={Geochimica et Cosmochimica Acta}, publisher={Elsevier BV}, author={Sherman, David M and Randall, Simon R}, year={2003}, month=nov, pages={4223–4230} }

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