## Abstract New psudopotentials of higher quality have been used in __ab initio__ molecular calculations. Simple molecular systems like Li~2~, LiH, and BeH~2~ have been investigated with varying basis sets. Energy, geometrical parameters, and dipole moments have been determined. The convergence pro
✦ LIBER ✦
Ab initio calculations on various forms of CH2Li2
✍ Scribed by Edvin Wisløff Nilssen; Anne Skancke
- Book ID
- 108354459
- Publisher
- Elsevier Science
- Year
- 1976
- Tongue
- English
- Weight
- 488 KB
- Volume
- 116
- Category
- Article
- ISSN
- 0022-328X
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