Problems in the comparison of theoretical and experimental hyperpolarizabilities
- Andrew Willetts
- Julia E. Rice
- et al.
- 1992
- The Journal of Chemical Physics
Paper
Publications
954 results at The Journal of Chemical Physics
Molecular dynamics simulation of adsorption of ions from aqueous media onto charged electrodes
- James N. Glosli
- Michael R. Philpott
- 1992
- The Journal of Chemical Physics
PaperComment on broadening of water microwave lines by collisions with helium atoms
- Sergio Maluendes
- A.D. McLean
- et al.
- 1992
- The Journal of Chemical Physics
PaperComputed self-consistent field and singles and doubles configuration interaction spectroscopic data and dissociation energies for the diatomics B2, C2, N2, O2, F2, CN, CP, CS, PN, SiC, SiN, SiO, SiP, and their ions
- A.D. McLean
- B. Liu
- et al.
- 1992
- The Journal of Chemical Physics
PaperState-to-state dynamics of atom+polyatom abstraction reactions. II. The H+C2H6/C3H8 → H2 (v′,J′) + C2H5/C3H7 reactions
- Geoffrey J. Germann
- Young-Duk Huh
- et al.
- 1992
- The Journal of Chemical Physics
PaperDecomposition of the chemisorption bond by constrained variations: Order of the variations and construction of the variational spaces
- Paul S. Bagus
- Francesc Illas
- 1992
- The Journal of Chemical Physics
PaperThirteen-atom clusters: Equilibrium geometries, structural transformations, and trends in Na, Mg, Al, and Si
- Ursula Röthlisberger
- Wanda Andreoni
- et al.
- 1992
- The Journal of Chemical Physics
PaperVanishing interfacial tension in an immiscible polymer blend
- Kenneth R. Shull
- Andrew J. Kellock
- et al.
- 1992
- The Journal of Chemical Physics
PaperAb initio determination of the nonlinear optical properties of HCl
- Brian L. Hammond
- Julia E. Rice
- 1992
- The Journal of Chemical Physics
PaperAn extensive ab initio study of the structures, vibrational spectra, quadratic force fields, and relative energetics of three isomers of Cl 2O2
- Timothy J. Lee
- Celeste McMichael Rohlfing
- et al.
- 1992
- The Journal of Chemical Physics
Paper