The Gaussian-2 (G2) theoretical procedure, based on ab initio molecular orbital theory, is used to calculate the energies of mixed triatomic clusters of carbon and silicon. The G2 energies are used to derive accurate binding energies which are compared with experimental values.
โฆ LIBER โฆ
A Theoretical Study of Two Forms of NCNCHCl and Their Interconversion, Relative Energies, and Infrared Spectra
โ Scribed by Skancke, Per N.
- Book ID
- 126429748
- Publisher
- American Chemical Society
- Year
- 1994
- Tongue
- English
- Weight
- 266 KB
- Volume
- 59
- Category
- Article
- ISSN
- 0022-3263
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