Chemical Physics Journal

Overview

publication venue for

• Nonadiabatic conical nodes are near but not at an elliptical conical intersection 2019
• State-specific dissociation in O₂-O₂ collisions by quasiclassical trajectory method 2017
• Investigation of oxygen vibrational relaxation by quasi-classical trajectory method 2015
• Thermochemical nonequilibrium analysis of O₂+Ar based on state-resolved kinetics 2015
• State-resolved master equation analysis of thermochemical nonequilibrium of nitrogen 2013
Measuring the intensity and phase of high-order harmonic emission from aligned molecules 2009
On the Landau-Zener approach to nonadiabatic transitions for a vertical conical intersection 2008
Bis-aryl substituted dioxaborines as electron-transport materials: a comparative density functional theory investigation with oxadiazoles and siloles 2005
An improved potential energy surface for the F+H₂ reaction 2005
Colloidal InP/ZnS core-shell nanocrystals studied by linearly and circularly polarized photoluminescence 2004
Photophysics of a fluorene co-polymer in solution and films 2002
Attosecond time-scale feedback control of coherent X-ray generation 2001
Peak shapes in femtosecond 2D correlation spectroscopy 2001
Two-dimensional spectroscopy and harmonically coupled anharmonic oscillators 2001
A theoretical analysis of the sum frequency generation spectrum of the water surface 2000
Structure of NaI ion pairs in water clusters 2000
Control of transition state spectra: a variational algorithm 1999
Modeling structure and dynamics of solvated molecular ions: Photodissociation and recombination in I(2)(-)(CO(2))(n) 1998
Penning ionization of C₆₀ and C₇₀ 1998
Nonequilibrium dissociation of hydrogen in a parallel-plate radio frequency discharge 1998
Reactions of N-2(+)(upsilon) with CO and NO at thermal energy 1998
Intra-and inter-molecular photoexcitations in a cyano-substituted poly(p-phenylenevinylene) 1998
A new potential for the description of intermolecular interactions for rigid biaxial molecules 1997
Photodissociation of ClONO2 at 193 and 248 nm 1996
On the Marcus model of electron transfer at immiscible liquid interfaces and its application to the semiconductor liquid interface 1996
Study of electron transfer at semiconductor liquid interfaces addressing the full system electronic structure 1996
Surface diffusion of H and CO on Cu/Ru(001): Evidence for long-range trapping by copper islands (vol 201, pg 273, 1995) 1996
SURFACE-DIFFUSION OF H AND CO ON CU/RU(001) - EVIDENCE FOR LONG-RANGE TRAPPING BY COPPER ISLANDS 1995
BIHALIDE ION COMBINATION REACTIONS IN SOLUTION - ELECTRONIC-STRUCTURE AND SOLVATION ASPECTS 1994
WELL AND BARRIER DYNAMICS AND ELECTRON-TRANSFER RATES - A MOLECULAR-DYNAMICS STUDY 1993
DETERMINATION OF QUANTUM-STATE-SPECIFIC GAS-SURFACE ENERGY-TRANSFER AND ADSORPTION PROBABILITIES AS A FUNCTION OF KINETIC-ENERGY 1993
VIBRATIONAL-RELAXATION TIMES FOR A MODEL HYDROGEN-BONDED COMPLEX IN A POLAR-SOLVENT 1993
DYNAMIC THEORY OF PROTON TUNNELING TRANSFER RATES IN SOLUTION - GENERAL FORMULATION 1993
ON THE CONSTRUCTION AND INTERPRETATION OF CORIOLIS-ADAPTED NORMAL-MODES 1992
CHEMICAL-REACTION RATES AND SOLVATION DYNAMICS IN ELECTROLYTE-SOLUTIONS - ION ATMOSPHERE FRICTION 1991
DISSOCIATION OF REMOTE BONDS BY OVERTONE EXCITATION - A MODEL STUDY OF HEAVY-ATOM BLOCKING 1989
COLLINEAR PROTON-TRANSFER IN A SYMMETRIC BIHALIDE SYSTEM 1989
PICOSECOND TIME-RESOLVED RESONANCE RAMAN-SPECTROSCOPY OF THE INITIAL TRANS TO CIS ISOMERIZATION IN THE BACTERIORHODOPSIN PHOTOCYCLE 1989
CONSTRAINED MOLECULAR-DYNAMICS AND THE MEAN POTENTIAL FOR AN ION-PAIR IN A POLAR-SOLVENT 1989
A SIMPLE DIPOLE ISOMERIZATION MODEL FOR NON-EQUILIBRIUM SOLVATION DYNAMICS IN REACTIONS IN POLAR-SOLVENTS 1984
1ST-PRINCIPLES PSEUDOPOTENTIAL IN THE LOCAL-DENSITY-FUNCTIONAL FORMALISM 1979
1ST PRINCIPLES HARTREE - FOCK AND LOCAL DENSITY PSEUDOPOTENTIALS 1978
MULTI-PHOTON IONIZATION SPECTRA OF PYRIDINE AND PYRAZINE 1978
CALCULATION OF EQUILIBRIUM CONFIGURATION AND INTERMOLECULAR FREQUENCIES OF WATER DIMERS AND HEXAGONAL ICE 1976
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Research

keywords

• 02 Physical Sciences, 03 Chemical Sciences, 09 Engineering