Density functional calculations on first‐row transition metals TV Russo, RL Martin, PJ Hay
The Journal of chemical physics 101 (9), 7729-7737, 1994
349 1994 Effective core potentials for DFT calculations TV Russo, RL Martin, PJ Hay
The Journal of Physical Chemistry 99 (47), 17085-17087, 1995
186 1995 New pseudospectral algorithms for electronic structure calculations: Length scale separation and analytical two‐electron integral corrections BH Greeley, TV Russo, DT Mainz, RA Friesner, JM Langlois, ...
The Journal of chemical physics 101 (5), 4028-4041, 1994
158 1994 A method for exponential propagation of large systems of stiff nonlinear differential equations RA Friesner, LS Tuckerman, BC Dornblaser, TV Russo
Journal of Scientific Computing 4, 327-354, 1989
152 1989 Application of gradient‐corrected density functional theory to the structures and thermochemistries of ScF3, TiF4, VF5, and CrF6 TV Russo, RL Martin, P Jeffrey Hay
The Journal of chemical physics 102 (20), 8023-8028, 1995
100 1995 LReO3 epoxidizes, cis-dihydroxylates, and cleaves alkenes as well as alkenylates aldehydes: toward an understanding of why MA Pietsch, TV Russo, RB Murphy, RL Martin, AK Rappé
Organometallics 17 (13), 2716-2719, 1998
69 1998 Solvation free energy calculations using a continuum dielectric model for the solvent and gradient-corrected density functional theory for the solute GJ Tawa, RL Martin, LR Pratt, TV Russo
The Journal of Physical Chemistry 100 (5), 1515-1523, 1996
55 1996 Bifurcation to spatially induced chaos in a reaction-diffusion system JA Vastano, T Russo, HL Swinney
Physica D: Nonlinear Phenomena 46 (1), 23-42, 1990
44 1990 Vibrational frequencies of transition metal chloride and oxo compounds using effective core potential analytic second derivatives TV Russo, RL Martin, PJ Hay, AK Rappé
The Journal of chemical physics 102 (23), 9315-9321, 1995
35 1995 Instabilities of front patterns in reaction-diffusion systems A Arneodo, J Elezgaray, J Pearson, T Russo
Physica D: Nonlinear Phenomena 49 (1-2), 141-160, 1991
33 1991 PS-GVB v2. 3, Schrodinger MN Ringnalda, JM Langlois, RB Murphy, BH Greeley, C Cortis, TV Russo, ...
Inc.: Portland, OR, 1996
17 1996 PS-GVB v2. 3 MN Ringnalda, JM Langlois, RB Murphy, BH Greeley, C Cortis, TV Russo, ...
Schrödinger, Inc, 1996
14 1996 PS-GVB v1. 00, Schroedinger MN Ringnalda, JM Langlois, BH Greeley, TV Russo, RP Muller, B Marten, ...
Inc.: Pasadena, 1993
10 1993 Modeling of a silver ion perturbed Belousov-Zhabotinskii oscillator T Russo
Journal of Physical Chemistry 94 (10), 4120-4122, 1990
6 1990 PS-GVB 2.24 from Schrödinger Inc., 1996 MN Ringnalda, J Langlois, BH Greeley, RB Murphy, TV Russo, C Cortis, ...
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3 New approaches for quantum chemical calculations on very large molecules RL Martin, TV Russo, PJ Hay
Los Alamos National Lab.(LANL), Los Alamos, NM (United States), 1996
1996 Application of Gradient-Corrected Density Functional Theory to the Structures and Thermochemistries of , , , and TV Russo, RL Martin, PJ Hay
1995 Agladze, KI A Arneodo, A Babloyantz, D Barkley, VN Biktashev, J Boissonade, ...
Physica D 49, 254, 1991
1991 Index of authors and papers to volume 49 KI Agladze, RA Kocharyan, VI Krinsky, A Arneodo, J Elezgaray, J Pearson, ...
Physica D 49, 478-480, 1991
1991