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Quantum Corrections in Constrained Systems

✍ Scribed by Okamoto, Naoko; Nakamura, Masayoshi


Book ID
115515837
Publisher
Institute of Pure and Applied Physics
Year
1996
Tongue
English
Weight
341 KB
Volume
96
Category
Article
ISSN
0033-068X

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πŸ“œ SIMILAR VOLUMES


Quantum-Mechanical Hamiltonians for Cons
✍ M. Menou; X. Chapuisat πŸ“‚ Article πŸ“… 1993 πŸ› Elsevier Science 🌐 English βš– 1001 KB

Whereas model constraints (e.g., frozen bonds, fixed bending or torsonial angles, rigid atomic groups, etc.) are often imposed in calculations of the potential energies of polyatomic molecules by quantum-chemical methods. the derivation of exact expressions for the corresponding kinetic energy opera