James Kubicki
James Kubicki
Professor of Geological Sciences, University of Texas at El Paso
Verified email at - Homepage
Cited by
Cited by
Photoinduced activation of CO 2 on Ti-based heterogeneous catalysts: Current state, chemical physics-based insights and outlook
VP Indrakanti, JD Kubicki, HH Schobert
Energy & Environmental Science 2 (7), 745-758, 2009
Kinetics of water-rock interaction
SL Brantley, JD Kubicki, AF White
Springer Verlag 10, 978-0, 2008
Ion adsorption at the rutile− water interface: Linking molecular and macroscopic properties
Z Zhang, P Fenter, L Cheng, NC Sturchio, MJ Bedzyk, M Předota, ...
Langmuir 20 (12), 4954-4969, 2004
Electric double layer at the rutile (110) surface. 1. Structure of surfaces and interfacial water from molecular dynamics by use of ab initio potentials
M Předota, AV Bandura, PT Cummings, JD Kubicki, DJ Wesolowski, ...
The Journal of Physical Chemistry B 108 (32), 12049-12060, 2004
Attenuated total reflectance Fourier-transform infrared spectroscopy of carboxylic acids adsorbed onto mineral surfaces
JD Kubicki, LM Schroeter, MJ Itoh, BN Nguyen, SE Apitz
Geochimica et Cosmochimica Acta 63 (18), 2709-2725, 1999
Development of a reactive force field for iron− oxyhydroxide systems
M Aryanpour, ACT Van Duin, JD Kubicki
The Journal of Physical Chemistry A 114 (21), 6298-6307, 2010
Derivation of Force Field Parameters for TiO2−H2O Systems from ab Initio Calculations
AV Bandura, JD Kubicki
The Journal of Physical Chemistry B 107 (40), 11072-11081, 2003
Simulations of the quartz (1011)/water interface: a comparison of classical force fields, ab initio molecular dynamics, and X-ray reflectivity experiments
AA Skelton, P Fenter, JD Kubicki, DJ Wesolowski, PT Cummings
The Journal of Physical Chemistry C 115 (5), 2076-2088, 2011
Sorption of the antibiotic ofloxacin to mesoporous and nonporous alumina and silica
KW Goyne, J Chorover, JD Kubicki, AR Zimmerman, SL Brantley
Journal of Colloid and Interface Science 283 (1), 160-170, 2005
Dissolution of nepheline, jadeite and albite glasses: toward better models for aluminosilicate dissolution
JP Hamilton, SL Brantley, CG Pantano, LJ Criscenti, JD Kubicki
Geochimica et Cosmochimica Acta 65 (21), 3683-3702, 2001
Molecular orbital theory study on surface complex structures of phosphates to iron hydroxides: Calculation of vibrational frequencies and adsorption energies
KD Kwon, JD Kubicki
Langmuir 20 (21), 9249-9254, 2004
Molecular dynamics simulations of SiO 2 melt and glass; ionic and covalent models
JD Kubicki, AC Lasaga
American Mineralogist 73 (9-10), 941-955, 1988
ATR-FTIR spectroscopic characterization of coexisting carbonate surface complexes on hematite
JR Bargar, JD Kubicki, R Reitmeyer, JA Davis
Geochimica et cosmochimica acta 69 (6), 1527-1542, 2005
Hydrogen-bonding network and OH stretch vibration of cellulose: comparison of computational modeling with polarized IR and SFG spectra
CM Lee, JD Kubicki, B Fan, L Zhong, MC Jarvis, SH Kim
The Journal of Physical Chemistry B 119 (49), 15138-15149, 2015
Tertiary model of a plant cellulose synthase
L Sethaphong, CH Haigler, JD Kubicki, J Zimmer, D Bonetta, S DeBolt, ...
Proceedings of the National Academy of Sciences 110 (18), 7512-7517, 2013
Quantum chemical study of arsenic (III, V) adsorption on Mn-oxides: Implications for arsenic (III) oxidation
M Zhu, KW Paul, JD Kubicki, DL Sparks
Environmental Science & Technology 43 (17), 6655-6661, 2009
ATR–FTIR and density functional theory study of the structures, energetics, and vibrational spectra of phosphate adsorbed onto goethite
JD Kubicki, KW Paul, L Kabalan, Q Zhu, MK Mrozik, M Aryanpour, ...
Langmuir 28 (41), 14573-14587, 2012
Probing cellulose structures with vibrational spectroscopy
M Makarem, CM Lee, K Kafle, S Huang, I Chae, H Yang, JD Kubicki, ...
Cellulose 26, 35-79, 2019
Adsorption of water on the TiO2 (rutile)(110) surface: a comparison of periodic and embedded cluster calculations
AV Bandura, DG Sykes, V Shapovalov, TN Troung, JD Kubicki, ...
The Journal of Physical Chemistry B 108 (23), 7844-7853, 2004
Adhesion of bacterial exopolymers to α-FeOOH: Inner-sphere complexation of phosphodiester groups
A Omoike, J Chorover, KD Kwon, JD Kubicki
Langmuir 20 (25), 11108-11114, 2004
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