A b initio Hartree-Fock calculations at the 6-31G\*//6-31G\* and MP3/6-31G\*//6-31G\* levels of theory are reported for propylamine. All ten stationary points needed in a description of the rotation around the C1-C2 bond have been located on the 6-31G\* surface and each of these points has been exam
β¦ LIBER β¦
Vibrational spectra of hexafluorodisiloxane and internal rotation around the SiO bond. An ab initio study
β Scribed by I.S. Ignatyev; T.R. Sundius
- Book ID
- 113258916
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 600 KB
- Volume
- 343
- Category
- Article
- ISSN
- 0166-1280
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