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O'Day P.A. 1999. Molecular environmental geochemistry. Reviews of Geophysics 37:249-274. |
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Sorption |
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Arai, Y. and D. L. Sparks. 2001. ATR-FTIR spectroscopic investigation on phosphate adsorption mechanisms at the ferrihydrite-water interface. J. Colloid Interf. Sci. 241: 317-326. |
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Dyer, J. A., P. Trivedi, N. C. Scrivner and D. L. Sparks. 2003. Lead sorption onto ferrihydrite. 2. Surface complexation modeling. Environ. Sci. Technol.37: 915-922. |
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Elzinga, E.J., and D.L. Sparks. 1999. Nickel sorption mechanisms in a pyrophyllite-montmorillonite mixture. J. Colloid Interf. Sci. 213:506-512. |
Elzinga, E. J., D. Peak and D. L. Sparks. 2001. Spectroscopic studies of Pb(II)-sulfate interactions at the goethite-water interface . Geochim. Cosmochim. Acta 65:2219-2230. |
Elzinga, E. J. and D. L. Sparks. 2001. Reaction condition effects on nickel sorption mechanisms in illite-water suspensions. Soil Sci. Soc. Am. J. 65:94-101. |
Elzinga, E. J. and D. L. Sparks. 2002. X-ray absorption spectroscopy study of the effects of pH and ionic strength on Pb(II) sorption to amorphous silica . Environ. Sci. Technol. 36: 4352 -4357. |
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Fitts, J. P., G. E. Brown, Jr., and G. A. Parks. 2000. Structural evolution of Cr(III) polymeric species at the γ-Al2O3 water interface. Environ. Sci. Technol. 34:5122-5128. |
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Lee Y.J., Elzinga E.J., Reeder R.J. 2005. Sorption mechanisms of zinc on hydroxyapatite: Systematic uptake studies and EXAFS spectroscopy analysis. Environ. Sci. Technol. 39:4042-4048. |
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Manning B.A., Kiser J.R., Kwon H., Kanel S.R. 2007. Spectroscopic investigation of Cr(III)- and Cr(VI)-treated nanoscale zerovalent iron. Environ. Sci. Technol. 41:586-592. |
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Miller A.W., Rodriguez D.R., Honeyman B.D. 2010. Upscaling sorption/desorption processes in reactive transport models to describe metal/radionuclide transport: a critical review. Environmental Science & Technology 44:7996-8007. |
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Pasilis S.P., Pemberton J.E. 2008. Spectroscopic investigation of uranyl(VI) and citrate coadsorption to Al2O3. Geochim. Cosmochim. Acta 72:277-287. |
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Jacquat O., Voegelin A., Villard A., Marcus M.A., Kretzschmar R. 2008. Formation of Zn-rich phyllosilicate, Zn-layered double hydroxide and hydrozincite in contaminated calcareous soils. Geochim. Cosmochim. Acta 72:5037-5054. |
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Scheidegger, A. M., G. M. Lamble and D. L. Sparks. 1997. Spectroscopic evidence for the formation of mixed-cation hydroxide phases upon metal sorption on clays and aluminum oxides. J. Colloid Interface Sci. 186:118-128. |
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Scheinost, A.C., R.G. Ford, and D.L. Sparks. 1999. The role of Al in the formation of secondary Ni precipitates on pyrophyllite, gibbsite, talc, and amorphous silica: A DRS Study. Geochim. Cosmochim. Acta 63:3193-3203. |
Scheinost, A. C., and D. L. Sparks. 2000. Formation of layered single- and double-metal hydroxide precipitates at the mineral/water interface: A multiple-scattering XAFS analysis. J. Colloid Interf. Sci. 223:167-178. |
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Thompson, H. A., G. A. Parks and G. E. Brown, Jr. 1999. Dynamic interactions of dissolution, surface adsorption, and precipitation in an aging cobalt(II)-clay-water system. Geochim. Cosmochim. Acta 63:1767-1779. |
Thompson, H. A., G. A. Parks and G. E. Brown, Jr. 1999. Ambient-temperature synthesis, evolution, and characterization of cobalt-aluminum hydrotalcite-like solids. Clays and Clay Minerals 47:425-438. |
Thompson, H. A., G. A. Parks and G. E. Brown, Jr. 2000. Formation and release of cobalt(II) sorption and precipitation products in aging kaolinite-water slurries J. Colloid Interface Sci. 222:241-253. |
Towle S.N., J.R. Bargar, G.E. Brown, Jr., and G.A. Parks. 1997. Surface precipitation of Co(II) (aq) on Al2O3. J. Colloid Interface Sci. 187:62-82. |
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Trainor T.P., G.E. Brown, Jr., and G.A. Parks.2000. Adsorption and precipitaton of aqueous Zn(II) on alumina powders. J. Colloid Interface Sci. 231:359-372. |
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Hunger, S., H. Cho, J.T. Sims, and D.L. Sparks. 2004. Direct speciation of phosphorus in alum-amended poultry litter: Solid-state P-31 NMR investigation. Environ. Sci. Technol. 38:674-681. |
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Jacobson A.R., Dousset S., Andreux F., Baveye P.C. 2007. Electron microprobe and synchrotron X-ray fluorescence mapping of the heterogeneous distribution of copper in high-copper vineyard soils. Environ. Sci. Technol. 41:6343-6349. |
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Karlsson T., Skyllberg U. 2007. Complexation of zinc in organic soils - EXAFS evidence for sulfur associations. Environ. Sci. Technol. 41:119-124. |
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Ryser, A.L., D.G. Strawn, M.A. Marcus, S. Fakra, J.L. Johnson-Maynard, and G. Moller. 2006. Microscopically focused synchrotron X-ray investigation of selenium speciation in soils developing on reclaimed mine lands. Environ. Sci. Technol. 40:462-467. |
*Sarret G., Saumitou-Laprade P., Bert V., Proux O., Hazemann J.L., Traverse A., Marcus M.A., Manceau A. 2002. Forms of zinc accumulated in the hyperaccumulator Arabidopsis halleri. Plant Physiology 130:1815-1826. |
Sarret G.r., Saumitou-Laprade P., Bert V.r., Proux O., Hazemann J.-L., Traverse A.s., Marcus M.A., Manceau A. 2002. Forms of zinc accumulated in the hyperaccumulator Arabidopsis halleri. Plant Physiology 130:1815-1826. |
Sarret G., Harada E., Choi Y.E., Isaure M.P., Geoffroy N., Fakra S., Marcus M.A., Birschwilks M., Clemens S., Manceau A. 2006. Trichomes of tobacco excrete zinc as zinc-substituted calcium carbonate and other zinc-containing compounds. Plant Physiology 141:1021-1034. |
Scheckel, K.G., E. Lombi, S.A. Rock, and N.J. McLaughlin. 2004. In vivo synchrotron study of thallium speciation and compartmentation in lberis intermedia. Environ. Sci. Technol. 38:5095-5100. |
Scheidegger A.M., Vespa M., Wieland E., Harfouche M., Grolimund D., Dahn R., Jenni A., Scrivener K. 2006. Micro-scale chemical speciation of highly heterogeneous cementitious materials using synchrotron-based X-ray absorption spectroscopy. Chimia 60:149-149. |
Scheinost A.C., Rossberg A., Vantelon D., Xifra I., Kretzschmar R., Leuz A.K., Funke H., Johnson C.A. 2006. Quantitative antimony speciation in shooting-range soils by EXAFS spectroscopy. Geochim. Cosmochim. Acta 70:3299-3312. |
Schroth A.W., Bostick B.C., Kaste J.M., Friedland A.J. 2008. Lead sequestration and species redistribution during soil organic matter decomposition. Environ. Sci. Technol. 42:3627-3633. |
Schuwirth N., Voegelin A., Kretzschmar R., Hofmann T. 2007. Vertical distribution and speciation of trace metals in weathering flotation residues of a zinc/lead sulfide mine. Jouranal of Environmental Quality 36:61-69. |
*Seiter, J.M., K. E. Staats-Borda, M. Ginder-Vogel and D.L. Sparks. 2008. XANES spectroscopic analysis of phosphorus speciation in alum-amended poultry litter. J. Environ. Qual. 37:477-485. |
*Shimizu M., Arai Y., Sparks D.L. 2011. Multiscale assessment of methylarsenic reactivity in soil. 2. Distribution and speciation in soil. Environmental Science & Technology 45:4293-4299. |
Shober, A.L., D.L. Hesterberg, J.T. Sims, and S. Gardner. 2006. Characterization of phosphorus species in biosolids and manures using XANES spectroscopy. J. Environ. Qual. 35:1983-1993. |
Strawn D.G., Baker L.L. 2008. Speciation of Cu in a contaminated agricultural soil measured by XAFS, μ-XAFS, and μ-XRF. Environ. Sci. Technol. 42:37-42. |
Terzano R., Spagnuolo M., Vekemans B., Nolf W.D., Janssens K., Falkenberg G., Fiore S., Ruggiero P. 2007. Assessing the origin and fate of Cr, Ni, Cu, Zn, Pb, and V in industrial polluted soil by combined microspectroscopic techniques and bulk extraction methods. Environ. Sci. Technol. 41:6762. |
Thakali S., Allen H.E., Di Toro D.M., Ponizovsky A.A., Rooney C.P., Zhao F.J., McGrath S.P., Criel P., Van Eeckhout H., Janssen C.R., Oorts K., Smolders E. 2006. Terrestrial biotic ligand model. 2. Application to Ni and Cu toxicities to plants, invertebrates, and microbes in soil. Environ. Sci. Technol. 40:7094-7100. |
Tokunaga T.K., Wan J.M., Kim Y.M., Sutton S.R., Newville M., Lanzirotti A., Rao W. 2008. Real-time X-ray absorption spectroscopy of uranium, iron, and manganese in contaminated sediments during bioreduction. Environ. Sci. Technol. 42:2839-2844. |
Utsunomiya S., Ewing R.C. 2003. Application of high-angle annular dark field scanning transmission electron microscopy, scanning transmission electron microscopy-energy dispersive X-ray spectrometry, and energy-filtered transmission electron microscopy to the characterization of nanoparticles in the environment. Environ. Sci. Technol. 37:786-791. |
Vespa, M., R. Dahn, E. Gallucci, D. Grolimund, E. Wieland, and A.M. Scheidegger. 2006. Microscale Investigations of Ni Uptake by Cement Using a Combination of Scanning Electron Microscopy and Synchrotron-Based Techniques. Environ. Sci. Technol. 40:7702-7709. |
Vespa M., Dahn R., Grolimund D., Wieland E., Scheidegger A.M. 2007. Co speciation in hardened cement paste: A macro- and micro-spectroscopic investigation. Environ. Sci. Technol. 41:1902-1908. |
*Voegelin A., Weber F.A., Kretzschmar R. 2007. Distribution and speciation of arsenic around roots in a contaminated riparian floodplain soil: Micro-XRF element mapping and EXAFS spectroscopy. Geochim. Cosmochim. Acta 71:5804-5820. |
Violante, A., M. Ricciardella, S. Del Gaudio, and M. Pigna. 2006. Coprecipitation of arsenate with metal oxides: Nature, mineralogy, and reactivity of aluminum precipitates. Environ. Sci. Technol. 40:4961-4967. |
Werner M.L., Nico P.S., Marcus M.A., Anastasio C. 2007. Use of micro-XANES to speciate chromium in airborne fine particles in the Sacramento Valley. Environ. Sci. Technol. 41:4919-4924. |
Wiramanaden C.I.E., Liber K., Pickering I.J. 2010. Selenium speciation in whole sediment using x-ray absorption spectroscopy and micro x-ray fluorescence imaging. Environmental Science & Technology 44:5389-5394. |
Xu S.P., Jaffe P.R. 2006. Effects of plants on the removal of hexavalent chromium in wetland sediments. Journal of Environmental Quality 35:334-341. |
Xu X.Y., McGrath S.P., Meharg A.A., Zhao F.J. 2008. Growing rice aerobically markedly decreases arsenic accumulation. Environ. Sci. Technol. 42:5574-5579. |
Yoon T.H., Benzerara K., Ahn S., Luthy R.G., Tyliszczak T., Brown G.E. 2006. Nanometer-scale chemical heterogeneities of black carbon materials and their impacts on PCB sorption properties: Soft X-ray spectromicroscopy study. Environ. Sci. Technol. 40:5923-5929. |
Zachara J.M., Ainsworth C.C., Brown G.E., Catalano J.G., McKinley J.P., Qafoku O., Smith S.C., Szecsody J.E., Traina S.J., Warner J.A. 2004. Chromium speciation and mobility in a high level nuclear waste vadose zone plume. Geochim. Cosmochim. Acta 68:13-30. |
Zavala Y.J., Gerads R., Gurleyuk H., Duxbury J.M. 2008. Arsenic in rice: II. Arsenic speciation in USA grain and implications for human health. Environ. Sci. Technol. 42:3861-3866. |
Mineral/Microbe Interactions |
Bargar J.R., Tebo B.M., Bergmann U., Webb S.M., Glatzel P., Chiu V.Q., Villalobos M. 2005. Biotic and abiotic products of Mn(II) oxidation by spores of the marine Bacillus sp. strain SG-1. American Mineralogist 90:143-154. |
Bargar J.R., Fuller C.C., Marcus M.A., Brearley A.J., De la Rosa M.P., Webb S.M., Caldwell W.A. 2009. Structural characterization of terrestrial microbial Mn oxides from Pinal Creek, AZ. Geochim. Cosmochim. Acta 73:889-910. |
Borrok D., Fein J.B. 2004. Distribution of protons and Cd between bacterial surfaces and dissolved humic substances determined through chemical equilibrium modeling. Geochim. Cosmochim. Acta 68:3043-3052. |
*Boyanov, M.I., S.D. Kelly, K.M. Kemner, B.A. Bunker, J.B. Fein, and D.A. Fowle. 2003. Adsorption of cadmium to Bacillus subtilis bacterial cell walls: a pH-dependent X-ray absorption fine structure spectroscopy study. Geochim. Cosmochim. Acta 67:3299-3311. |
Boyanov M.I., O'Loughlin E.J., Roden E.E., Fein J.B., Kemner K.M. 2007. Adsorption of Fe(II) and U(VI) to carboxyl-functionalized microspheres: The influence of speciation on uranyl reduction studied by titration and XAFS. Geochim. Cosmochim. Acta 71:1898-1912. |
Brown, G.E., V.E. Henrich, W.H. Casey, D.L. Clark, C. Eggleston, A. Felmy, D.W. Goodman, M. Gratzel, G. Maciel, M.I. McCarthy, K.H. Nealson, D.A. Sverjensky, M.F. Toney, and J.M. Zachara. 1999. Metal oxide surfaces and their interactions with aqueous solutions and microbial organisms. Chem. Rev. 99:77-174. |
Brooks S.C., Fredrickson J.K., Carroll S.L., Kennedy D.W., Zachara J.M., Plymale A.E., Kelly S.D., Kemner K.M., Fendorf S. 2003. Inhihition of bacterial U(VI) reduction by calcium. Environ. Sci. Technol. 37:1850-1858. |
Burgos W.D., McDonough J.T., Senko J.M., Zhang G.X., Dohnalkova A.C., Kelly S.D., Gorby Y., Kemner K.M. 2008. Characterization of uraninite nanoparticles produced by Shewanella oneidensis MR-1. Geochim. Cosmochim. Acta 72:4901-4915. |
Burnett P.G.G., Daughney C.J., Peak D. 2006. Cd adsorption onto Anoxybacillus flavithermus: Surface complexation modeling and spectroscopic investigations. Geochim. Cosmochim. Acta 70:5253-5269. |
Campbell K.M., Malasarn D., Saltikov C.W., Newman D.K., Hering J.G. 2006. Simultaneous microbial reduction of iron(III) and arsenic(V) in suspensions of hydrous ferric oxide. Environ. Sci. Technol. 40:5950-5955. |
Casey W.H., Rustad J.R. 2007. Reaction dynamics, molecular clusters, and aqueous geochemistry. Annual Review of Earth and Planetary Sciences 35:21-46. |
Dolsch E., Basile-Dolsch I., Rose J., Masion A., Borschneck D., Hazemann J.L., SaintMacary H., Bottero J.Y. 2006. New combination of EXAFS spectroscopy and density fractionation for the speciation of chromium within an andosol. Environ. Sci. Technol. 40:7602-7608. |
Domagal-Goldman, S.D., K.W. Paul, D.L. Sparks and J.D. Kubicki. 2009. Quantum chemical study of the Fe(III)-desferrioxamine B siderophore complex—Electronic structure, vibrational frequencies, and equilibrium Fe-isotope fractionation. Geochim. Cosmochim. Acta 73(1):1-12. |
Dynes J.J., Tyliszczak T., Araki T., Lawrence J.R., Swerhone G.D.W., Leppard G.G., Hitchcock A.P. 2006. Speciation and quantitative mapping of metal species in microbial biofilms using scanning transmission X-ray microscopy. Environ. Sci. Technol. 40:1556-1565. |
Fukushi K., Sverjensky D.A. 2007. A predictive model (ETLM) for arsenate adsorption and surface speciation on oxides consistent with spectroscopic and theoretical molecular evidence. Geochim. Cosmochim. Acta 71:3717-3745. |
*Holman, H.N., K. Nieman, D.L. Sorensen, C.D. Miller, M.C. Martin, T. Borch, W.R. McKinney, and R.C. Sims. 2002. Catalysis of PAH biodegradation by humic acid shown in synchrotron infrared studies. Environ. Sci. Technol. 36:1276-1280. |
*Huang J.-H., Elzinga E.J., Brechbuehl Y., Voegelin A., Kretzschmar R. 2011. Impacts of Shewanella putrefaciens strain CN-32 cells and extracellular polymeric substances on the sorption of As(V) and As(III) on Fe(III)-(hydr)oxides. Environmental Science & Technology 45:2804-2810. |
*Huang J.-H., Voegelin A., Pombo S.A., Lazzaro A., Zeyer J., Kretzschmar R. 2011. Influence of arsenate adsorption to ferrihydrite, goethite, and boehmite on the kinetics of arsenate reduction by Shewanella putrefaciens strain CN-32. Environmental Science & Technology 45:7701-7709. |
Huang P.M., Wang M.K., Chiu C.Y. 2005. Soil mineral-organic matter-microbe interactions: Impacts on biogeochemical processes and biodiversity in soils. Pedobiologia 49:609-635. |
Johnson K.J., Cygan R.T., Fein J.B. 2006. Molecular simulations of metal adsorption to bacterial surfaces. Geochim. Cosmochim. Acta 70:5075-5088. |
Kelly, S.D., K.M. Kemner, J.B. Fein, D.A. Fowle, M.I. Boyanov, B.A. Bunker, and N. Yee. 2002. X-ray absorption fine structure determination of pH-dependent U-bacterial cell wall interactions. Geochim. Cosmochim. Acta 66:3855-3871. |
Kemner, K.M., S.D. Kelly, B. Lai, J. Maser, E.J. O'Loughlin, D. Sholto-Douglas, Z.H. Cai, M.A. Schneegurt, C.F. Kulpa, and K.H. Nealson. 2004. Elemental and redox analysis of single bacterial cells by X-ray microbeam analysis. Science 306:686-687. |
*Kemner, K.M., E.J. O'Loughlin, S.D.Kelly, and M. I. Boyanov. 2005. Synchrotron x-ray investigations of mineral-microbe-metal interactions. Elements 1:66-70. |
Kubicki, J.D., K.P. Paul, and D. L. Sparks. 2008. Periodic density functional theory calculations of bulk and the (010) surface of goethite. Geochemical Transactions 9:4. |
Liu C.G., Zachara J.M., Gorby Y.A., Szecsody J.E., Brown C.F. 2001. Microbial reduction of Fe(III) and sorption/precipitation of Fe(II) on Shewanella putrefaciens strain CN32. Environ. Sci. Technol. 35:1385-1393. |
Murray K.J., Tebo B.M. 2007. Cr(III) is indirectly oxidized by the Mn(II)-Oxidizing bacterium Bacillus sp strain SG-1. Environ. Sci. Technol. 41:528-533. |
Naeem A., Woertz J.R., Fein J.B. 2006. Experimental measurement of proton, Cd, Pb, Sr, and Zn adsorption onto the fungal species Saccharomyces cerevisiae. Environ. Sci. Technol. 40:5724-5729. |
Park J.M., Lee J.S., Lee J.U., Chon H.T., Jung M.C. 2006. Microbial effects on geochemical behavior of arsenic in As-contaminated sediments. Journal of Geochemical Exploration 88:134-138. |
Paul, K. W., M. J. Borda, J. D. Kubicki, and D. L. Sparks. 2005. Effect of dehydration on sulfate coordination and speciation at the Fe-(Hydr)oxide-water interface: A molecular orbital/density functional theory and Fourier Transform Infrared Spectroscopic investigation. Langmuir 21:11071-11078. |
Paul, K.W., J.D. Kubicki and D. L. Sparks. 2007. Sulphate adsorption at the Fe (hydr)oxide–H2O interface: comparison of cluster and periodic slab DFT predictions, European J Soil Sci. 58:978-988. |
Peña J., Bargar J.R., Sposito G. 2011. Role of bacterial biomass in the sorption of Ni by biomass-birnessite assemblages. Environmental Science & Technology 45:7338-7344. |
Rhine E.D., Garcia-Dominguez E., Phelps C.D., Young L.Y. 2005. Environmental microbes can speciate and cycle arsenic. Environ. Sci. Technol. 39:9569-9573. |
Ridley M.K., Hiemstra T., van Riemsdijk W.H., Machesky M.L. 2009. Inner-sphere complexation of cations at the rutile-water interface: A concise surface structural interpretation with the CD and MUSIC model. Geochim. Cosmochim. Acta 73:1841-1856. |
Sarret, G. et.al. 1999. Structural determination of Pb binding sites in Penicillium chrysogenum cell walls by EXAFS spectroscopy and solution chemistry. J. Synchrotron Rad. 6:414-416. |
Suzuki, Y., S.D. Kelly, K.M. Kemner, and J.F. Banfield. 2002. Radionuclide contamination: Nanometre-size products of uranium bioreduction. Nature 419:134-134. |
Sverjensky D.A., Fukushi K. 2006. A predictive model (ETLM) for As(III) adsorption and surface speciation on oxides consistent with spectroscopic data. Geochim. Cosmochim. Acta 70:3778-3802. |
*Templeton, A.S., T.P. Trainor, A.M. Spormann, M. Newville, S.R. Sutton, A. Dohnalkova, Y. Gorby, and G.E. Brown. 2003. Sorption versus biomineralization of Pb(II) within Burkholderia cepacia biofilms. Environ. Sci. Technol. 37:300-307. |
Toner B., Manceau A., Webb S.M., Sposito G. 2006. Zinc sorption to biogenic hexagonal-birnessite particles within a hydrated bacterial biofilm. Geochim. Cosmochim. Acta 70:27-43. |
vanRiemsdijk W.H., Koopal L.K., Kinniburgh D.G., Benedetti M.F., Weng L. 2006. Modeling the interactions between humics, ions, and mineral surfaces. Environ. Sci. Technol. 40:7473-7480. |
Villalobos M., Lanson B., Manceau A., Toner B., Sposito G. 2006. Structural model for the biogenic Mn oxide produced by Pseudomonas putida. American Mineralogist 91:489-502. |
Wang Q. ,E. Iriowen, S. Yuan, D.L. Sparks. 2011. Impact of sediment from St. Jones River, Delaware, USA on microbial functional stability in two local soils. J Bioremed Biodegrad S1:005. |
Wu Y.X., Deng B.L., Xu H.F., Kornishi H. 2005. Chromium(III) oxidation coupled with microbially mediated Mn(II) oxidation. Geomicrobiology Journal 22:161-170. |
Molecular and Surface Complexation Modeling |
Adamescu A., Hamilton I.P., Al-Abadleh H.A. 2011. Thermodynamics of dimethylarsinic acid and arsenate interactions with hydrated iron-(oxyhydr)oxide clusters: DFT calculations. Environmental Science & Technology 45:10438-10444. |
Domagal-Goldman, S.D., K.W. Paul, D.L. Sparks and J.D. Kubicki. 2009. Quantum chemical study of the Fe(III)-desferrioxamine B siderophore complex—Electronic structure, vibrational frequencies, and equilibrium Fe-isotope fractionation. Geochim. Cosmochim. Acta 73(1):1-12. |
Fukushi K., Sverjensky D.A. 2007. A predictive model (ETLM) for arsenate adsorption and surface speciation on oxides consistent with spectroscopic and theoretical molecular evidence. Geochim. Cosmochim. Acta 71:3717-3745. |
Juhasz A.L., Weber J., Smith E. 2011. Predicting arsenic relative bioavailability in contaminated soils using meta analysis and relative bioavailability/bioaccessibility regression models. Environmental Science & Technology 45:10676-10683. |
Kubicki, J.D., K.P. Paul, and D. L. Sparks. 2008. Periodic density functional theory calculations of bulk and the (010) surface of goethite. Geochemical Transactions 9:4. |
*Paul K.W., Borda M.J., Kubicki J.D., Sparks D.L. 2005. Effect of dehydration on sulfate coordination and speciation at the Fe-(Hydr)oxide-water interface: A molecular orbital/density functional theory and Fourier transform infrared spectroscopic investigation. Langmuir 21:11071-11078. |
Paul, K.W., J.D. Kubicki and D. L. Sparks. 2006. Quantum chemical calculations of sulfate adsorption at the Al- and Fe-(Hydr)oxide-H2O interface-Estimation of Gibbs free energies. Environ. Sci. Technol. 40:7717 -7724. |
Paul, K.W., J.D. Kubicki and D. L. Sparks. 2007. Sulphate adsorption at the Fe (hydr)oxide–H2O interface: comparison of cluster and periodic slab DFT predictions, European J Soil Sci. 58:978-988. |
Phillips K.L., Di Toro D.M., Sandler S.I. 2010. Prediction of soil sorption coefficients using model molecular structures for organic matter and the quantum mechanical COSMO-SAC model. Environmental Science & Technology 45:1021-1027. |
Ridley M.K., Hiemstra T., van Riemsdijk W.H., Machesky M.L. 2009. Inner-sphere complexation of cations at the rutile-water interface: A concise surface structural interpretation with the CD and MUSIC model. Geochim. Cosmochim. Acta 73:1841-1856. |
Sverjensky D.A., Fukushi K. 2006. A predictive model (ETLM) for As(III) adsorption and surface speciation on oxides consistent with spectroscopic data. Geochim. Cosmochim. Acta 70:3778-3802. |
vanRiemsdijk W.H., Koopal L.K., Kinniburgh D.G., Benedetti M.F., Weng L. 2006. Modeling the interactions between humics, ions, and mineral surfaces. Environ. Sci. Technol. 40:7473-7480. |
Reviews |
Borda, M.J., and D.L. Sparks. In Press. Kinetics and Mechanisms of Sorption/Desorption in Soils: A Multi-Scale Assessment, In A. Violante, et al., eds. Biophysico-Chemical Processes Of Metals And Metalloids In Soil Environments. IUPAC. |
*Brown, G.E., and G.A. Parks. 2001. Sorption of trace elements on mineral surfaces: Modern perspectives from spectroscopic studies, and comments on sorption in the marine environment. Intern. Geol. Rev. 43:963-1073. |
*Brown, G.E. Jr. and N.C. Sturchio. 2002. Overview of synchrotron radiation applications to low temperature geochemistry and environmental science. p. 1-115. In Fenter et. al. (eds.) Applications of Synchrotron Radiation in Low-Temperature Geochemistry and Environmental Sciences, Rev Mineral Geochem 49, Washington D.C. |
Brown, G.E.Jr., et al. 2004. Molecular Environmental Science: An Assessment of Research Accomplishments, Available Synchrotron Radiation Facilities, and Needs. SLAC-Report-704. Stanford Linear Accelerator Center, Stanford Synchrotron Radiation Laboratory, Stanford University, Stanford, CA. |
Chan, C.S., G. De Stasio, S.A. Welch, M. Girasole, B.H. Frazer, M.V. Nesterova, S. Fakra, and J.F. Banfield. 2004. Microbial polysaccharides template assembly of nanocrystal fibers. Science 303:1656-1658. |
Chorover J., Kretzschmar R., Garcia-Pichel F., Sparks D.L. 2007. Soil biogeochemical processes within the Critical Zone. Elements 3:321-326. |
Chorover J., Brusseau M.L. 2008. Kinetics of Sorption—Desorption, Kinetics of Water-Rock Interaction. pp. 109-149. |
Fendorf, S.E., D.L. Sparks, G.M. Lamble, and M.J. Kelley. 1994. Applications of x-ray absorption fine structure spectroscopy to soils. Soil Sci. Soc. Am. J. 58:1583-1595. |
Fortin, D. 2004. What biogenic minerals tell us. Science 303:1618-1619. |
*Ginder-Vogel, M. and D. L. Sparks. 2010. The impacts of X-ray absorption spectroscopy on understanding soil processes and reaction mechanisms, p. 1-26. In Developments in Soil Science 34: Synchrotron-based Techniques in Soils and Sediments. B. Singh and M. Grafe, eds. Elsevier, Burlington, MA. |
Hirschmugl, C.J. 2002. Applications of storage ring infrared spectromicroscopy and reflection-absorption spectroscopy to geochemistry and environmental science. p. 317-340. In Fenter et. al. (eds.) Applications of Synchrotron Radiation in Low-Temperature Geochemistry and Environmental Sciences, Rev Mineral Geochem 49, Washington D.C. |
Hochella, M. F., Jr., J. F. Rakovan, K. M. Rosso, B. R. Bickmore and E. Rufe. 1999. New directions in mineral surface geochemical research using scanning probe microscopes. p. 37-56. In D. L. Sparks and T. J. Grundl (eds) Mineral-Water Interfacial Reactions, Kinetics and Mechanisms , ACS Symposium Series No. 715, Washington, DC. |
Katz, L. E. and E. J. Boyle-Wight. 2001. Application of spectroscopic methods to sorption model parameter estimation. p. 189-212. In H. M. Selim and D. L. Sparks (eds) Physical and chemical processes of water and solute transport/retention in soils, SSSA Spec. Pub. 56, SSSA, Madison, WI. |
Kirkpatrick, R. J., Y. Kim, C. A. Weiss, R. T. Cygan. 1997. NMR spectoscopic investigations of surface and interlayer species on minerals, clays and other oxides. p. 157-168. In Gonis et al. (eds.) Properties of Complex Inorganic Solids, Plenum Press, New York. |
Lefevre, G. 2004. In situ Fourier-transform infrared spectroscopy studies of inorganic ions adsorption on metal oxides and hydroxides. Adv Colloid Interfac 107:109-123. |
*Manceau, A., M.A. Marcus and N. Tamura. 2002. Quantitative speciation of heavy metals in soils and sediments by synchrotron X-ray techniques p. 341-428. In Fenter et. al. (eds.) Applications of Synchrotron Radiation in Low-Temperature Geochemistry and Environmental Sciences, Rev Mineral Geochem 49, Washington D.C. |
Matocha, C.J., K.G. Scheckel, and D.L. Sparks. 2005. Kinetics and mechanisms of soil biogeochemical processes, p. 309-342, In M. A. Tabatbai and D. L. Sparks, eds. Chemical Processes in Soils. Soil Science Society of America, Madison, WI. |
McNear, D.H., Jr., R. Tappero, and D.L. Sparks. 2005. Shining light on metals in the environment. Elements 1:211-216. |
Newman, D.K., and J.F. Banfield. 2002. Geomicrobiotogy: How molecular-scale interactions underpin biogeochemical systems. Science 296:1071-1077. |
Roberts, D.R., A.C. Scheinost and D.L. Sparks. 2003. Zinc speciation in contaminated soils combing direct and indirect characterization methods. p. 187-227. In H.M. Selim and W.L. Kingery (eds.) Geochemical and Hydrological Reactivity of Heavy Metals in Soils, Lewis Publishers, Boca Raton. |
Scheidegger, A. M. and D. L. Sparks. 1996. A critical assessment of sorption-desorption mechanisms at the soil mineral/water interface. Soil Sci. 161:813-831 |
*Sparks, D.L. 2005. Sorption | Metals, p. 532-537, In D. Hillel, et al., eds. Encyclopedia of Soils in the Environment. Elsevier Ltd., Oxford UK. |
*Sparks, D.L. 2005. Sorption-Desorption, Kinetics, p. 556-561, In D. Hillel, et al., eds. Encyclopedia of Soils in the Environment. Elsevier Ltd., Oxford UK. |
Sutton, S.R. et.al. 2002. Microfluoresence and microtomography analyses of heterogeneous earth and environmental materials p. 429-484 In Fenter et. al. (eds.) Applications of Synchrotron Radiation in Low-Temperature Geochemistry and Environmental Sciences, Rev Mineral Geochem 49, Washington D.C. |
Tebo, B.M., J.R. Bargar, B.G. Clement, G.J. Dick, K.J. Murray, D. Parker, R. Verity, and S.M. Webb. 2004. Biogenic manganese oxides: Properties and mechanisms of formation. Annu Rev Earth Pl Sc 32:287-328. |
Toor, G.S., S. Hunger, J.D. Peak, J.T. Sims and D.L. Sparks. 2006. Advances in the Characterization of Phosphorus in Organic Wastes: Environmental and Agronomic Applications, In Advances in Agronomy, 89:1-72 |
* Required Papers |