𝔖 Bobbio Scriptorium
✦   LIBER   ✦

An ab initio investigation of the harmonic force fields and vibrational frequencies of ethylene and cis- and trans-1,2-difluoroethylene

✍ Scribed by Charles W. Bock; Philip George; Mendel Trachtman

Publisher
Elsevier Science
Year
1979
Tongue
English
Weight
955 KB
Volume
76
Category
Article
ISSN
0022-2852

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

An ab initio study of the geometry, harm
An ab initio study of the geometry, harmonic and anharmonic force fields, and fundamental vibrational frequencies of cis- and trans- thiolformic acid
✍ Charles W. Bock; Mendel Trachtman; Philip George πŸ“‚ Article πŸ“… 1980 πŸ› John Wiley and Sons 🌐 English βš– 774 KB

## Abstract The geometry, harmonic and anharmonic force fields, and fundamental vibrational frequencies of __cis__‐ and __trans__‐thiolformic acid are studied __ab initio__ in the 4‐31G basis set. An extensive comparison is made between changes in diagonal and off‐diagonal quadratic and cubic force

An ab initio calculation of the force fi
An ab initio calculation of the force field and vibrational frequencies of H2 CNH
✍ P. Botschwina πŸ“‚ Article πŸ“… 1974 πŸ› Elsevier Science 🌐 English βš– 490 KB

The &monk foice field of mgh&neimine (HzCNH) in the A' symmetry species has been calculated.from ab initiq SCF wavefunctions and is compared with the force Gel& of ethylene and formaldehyde. Vibrational frequenties and normal modes of vibrations have been calculated in o&er to give an explanationof