The efficiency of the theoretical methods to obtain exact expressions of classical and quantum-mechanical Hamiltonians for N-particle systems described in terms of curvilinear coordinates (q), is shown to depend strongly on whether the system is subjected to constraints or not. If it is free, the me
✦ LIBER ✦
Position versus momentum projections for constrained Hamiltonian systems
✍ Scribed by Werner M. Seiler
- Book ID
- 110386075
- Publisher
- Springer US
- Year
- 1998
- Tongue
- English
- Weight
- 126 KB
- Volume
- 19
- Category
- Article
- ISSN
- 1017-1398
No coin nor oath required. For personal study only.
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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