| Role of water in electron-initiated processes and radical chemistry: Issues and scientific advances BC Garrett, DA Dixon, DM Camaioni, DM Chipman, MA Johnson, ... Chemical reviews 105 (1), 355-390, 2004 | 687 | 2004 |
| Isotopic fractionation of Mg2+ (aq), Ca2+ (aq), and Fe2+ (aq) with carbonate minerals JR Rustad, WH Casey, QZ Yin, EJ Bylaska, AR Felmy, SA Bogatko, ... Geochimica et Cosmochimica Acta 74 (22), 6301-6323, 2010 | 223 | 2010 |
| A polarizable, dissociating molecular dynamics model for liquid water JW Halley, JR Rustad, A Rahman The Journal of chemical physics 98 (5), 4110-4119, 1993 | 195 | 1993 |
| Investigating the behaviour of Mg isotopes during the formation of clay minerals J Wimpenny, CA Colla, QZ Yin, JR Rustad, WH Casey Geochimica et Cosmochimica Acta 128, 178-194, 2014 | 188 | 2014 |
| Interaction of water with the (1× 1) and (2× 1) surfaces of α-Fe2O3 (012) MA Henderson, SA Joyce, JR Rustad Surface Science 417 (1), 66-81, 1998 | 155 | 1998 |
| Structural criteria for the rational design of selective ligands: extension of the MM3 force field to aliphatic ether complexes of the alkali and alkaline earth cations BP Hay, JR Rustad Journal of the American Chemical Society 116 (14), 6316-6326, 1994 | 151 | 1994 |
| Molecular statics calculations of proton binding to goethite surfaces: A new approach to estimation of stability constants for multisite surface complexation models JR Rustad, AR Felmy, BP Hay Geochimica et Cosmochimica Acta 60 (9), 1563-1576, 1996 | 137 | 1996 |
| Molecular dynamics of liquid SiO 2 under high pressure JR Rustad, DA Yuen, FJ Spera Physical Review A 42 (4), 2081, 1990 | 127 | 1990 |
| Ewald methods for polarizable surfaces with application to hydroxylation and hydrogen bonding on the (012) and (001) surfaces of α-Fe2O3 E Wasserman, JR Rustad, AR Felmy, BP Hay, JW Halley Surface Science 385 (2-3), 217-239, 1997 | 120 | 1997 |
| Mechanism of the Hydration of Carbon Dioxide: Direct Participation of H2O versus Microsolvation MT Nguyen, MH Matus, VE Jackson, VT Ngan, JR Rustad, DA Dixon The Journal of Physical Chemistry A 112 (41), 10386-10398, 2008 | 119 | 2008 |
| An aqueous thermodynamic model for polymerized silica species to high ionic strength AR Felmy, H Cho, JR Rustad, MJ Mason Journal of Solution Chemistry 30, 509-525, 2001 | 117 | 2001 |
| Quantitative structure-stability relationship for potassium ion complexation by crown ethers. A molecular mechanics and ab initio study BP Hay, JR Rustad, CJ Hostetler Journal of the American Chemical Society 115 (24), 11158-11164, 1993 | 114 | 1993 |
| The influence of edge sites on the development of surface charge on goethite nanoparticles: A molecular dynamics investigation JR Rustad, AR Felmy Geochimica et cosmochimica acta 69 (6), 1405-1411, 2005 | 108 | 2005 |
| Molecular statics calculations for iron oxide and oxyhydroxide minerals: Toward a flexible model of the reactive mineral-water interface JR Rustad, AR Felmy, BP Hay Geochimica et Cosmochimica Acta 60 (9), 1553-1562, 1996 | 107 | 1996 |
| Quantum-chemical calculations of carbon-isotope fractionation in CO2 (g), aqueous carbonate species, and carbonate minerals JR Rustad, SL Nelmes, VE Jackson, DA Dixon The Journal of Physical Chemistry A 112 (3), 542-555, 2008 | 106 | 2008 |
| Dissolution of insulating oxide materials at the molecular scale CA Ohlin, EM Villa, JR Rustad, WH Casey Nature materials 9 (1), 11-19, 2010 | 105 | 2010 |
| Semiconducting large bandgap oxides as potential thermoelectric materials for high-temperature power generation? M Backhaus-Ricoult, J Rustad, L Moore, C Smith, J Brown Applied Physics A 116, 433-470, 2014 | 102 | 2014 |
| Interaction potential of in water from first principles calculations E Wasserman, JR Rustad, SS Xantheas The Journal of chemical physics 106 (23), 9769-9780, 1997 | 90 | 1997 |
| Oxygen-exchange pathways in aluminum polyoxocations JR Rustad, JS Loring, WH Casey Geochimica et Cosmochimica Acta 68 (14), 3011-3017, 2004 | 88 | 2004 |
| Molecular modeling of the surface charging of hematite: II. Optimal proton distribution and simulation of surface charge versus pH relationships JR Rustad, E Wasserman, AR Felmy Surface science 424 (1), 28-35, 1999 | 87 | 1999 |
