𝔖 Bobbio Scriptorium
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Vibrational assignment and force constants of S12

✍ Scribed by Ralf Steudel; David F. Eggers Jr.


Book ID
113373546
Publisher
Elsevier Science
Year
1975
Tongue
English
Weight
516 KB
Volume
31
Category
Article
ISSN
1386-1425

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Force constants, vibrational assignment
✍ Peter Botschwina; Edgar Nachbaur; Bernd M. Rode πŸ“‚ Article πŸ“… 1976 πŸ› Elsevier Science 🌐 English βš– 328 KB

Harmonic and several cubic force constants for HNCO have been calculated from ab initio SCF wavefunctions by kIlaY\*s force method. An exceptionally large value of 1.1 aJ A" is predicted for the stretch-bend coupling cons@nt fRla (NC, IiNC). Comparison is made betweerr the force constants cdcuhtec!