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The Journal of Chemical Physics|October 12, 2004
Statistical mechanical theory for the structure of steady state systems: application to a Lennard-Jones fluid with applied temperature gradientPhil Attard
The Journal of Chemical Physics|October 12, 2004
Accurate prediction of heat of formation by combining Hartree-Fock/density functional theory calculation with linear regression correction approachXue-Mei Duan, Guo-Liang Song, Zhen-Hua Li, et al.
The Journal of Chemical Physics|October 12, 2004
Correlated geminal wave function for molecules: an efficient resonating valence bond approachMichele Casula, Claudio Attaccalite, Sandro Sorella
The Journal of Chemical Physics|October 12, 2004
Dissociation energies of six NO2 isotopologues by laser induced fluorescence spectroscopy and zero point energy of some triatomic moleculesG Michalski, R Jost, D Sugny, et al.
The Journal of Chemical Physics|October 12, 2004
An optical-optical double resonance experiment in LiH molecules: lifetime measurements in the C stateN Bouloufa, L Cabaret, P Luc, et al.
The Journal of Chemical Physics|October 16, 2004
Bound state spectroscopy of NH-HeGalina Kerenskaya, Udo Schnupf, Michael C Heaven, et al.
The Journal of Chemical Physics|October 16, 2004
Quantum-classical limit of quantum correlation functionsAlessandro Sergi, Raymond Kapral
The Journal of Chemical Physics|October 16, 2004
Spectral implementation of some quantum algorithms by one- and two-dimensional nuclear magnetic resonanceRanabir Das, Anil Kumar
The Journal of Chemical Physics|October 16, 2004
Density functional theory for hyperfine coupling constants with the restricted-unrestricted approachZilvinas Rinkevicius, Lyudmyla Telyatnyk, Olav Vahtras, et al.
The Journal of Chemical Physics|October 16, 2004
Multiscale quantum propagation using compact-support wavelets in space and timeHaixiang Wang, Ramiro Acevedo, Heather Mollé, et al.
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