| 1 |
An ab initio study of solid nitromethane, HMX, RDX, and CL20: Successes and failures of DFT
Byrd EFC, Scuseria GE, Chabalowski CF
Journal of Physical Chemistry B, 108(35), 13100, 2004 |
| 2 |
Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions
Williams HL, Chabalowski CF
Journal of Physical Chemistry A, 105(3), 646, 2001 |
| 3 |
Reply to comment on "Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions"
Williams HL, Chabalowski CF
Journal of Physical Chemistry A, 105(49), 11158, 2001 |
| 4 |
Ab initio interaction potentials for simulations of dimethylnitramine solutions in supercritical carbon dioxide with cosolvents
Bukowski R, Szalewicz K, Chabalowski CF
Journal of Physical Chemistry A, 103(36), 7322, 1999 |
| 5 |
A semiclassical study of tunneling effects in aziridine
Guo Y, Wilson AK, Chabalowski CF, Thompson DL
Journal of Chemical Physics, 109(21), 9258, 1998 |
| 6 |
Ab initio potential energy surface for H+OCS reactions : Extended basis sets and correlation treatment (vol 98, pg 9488, 1994)
Rice BM, Chabalowski CF
Journal of Physical Chemistry A, 102(21), 3847, 1998 |
| 7 |
Performance of density functional theory on the potential-energy surface of the H+OCS system
Rice BM, Pai SV, Chabalowski CF
Journal of Physical Chemistry A, 102(35), 6950, 1998 |
| 8 |
Investigation of the CH3CN-CO2 potential energy surface using symmetry-adapted perturbation theory
Williams HL, Rice BM, Chabalowski CF
Journal of Physical Chemistry A, 102(35), 6981, 1998 |
| 9 |
Ab-Initio and DFT Potential-Energy Surfaces for Cyanuric Chloride Reactions
Pai SV, Chabalowski CF, Rice BM
Journal of Physical Chemistry A, 101(18), 3400, 1997 |
| 10 |
Ab initio and nonlocal density functional study of 1,3,5-trinitro-s-triazine (RDX) conformers
Rice BM, Chabalowski CF
Journal of Physical Chemistry A, 101(46), 8720, 1997 |
