## Self-consistent-field Calculations and Model Hamiltonians Hartree-Fock (HF) theory was developed in the early 1930s by the theoretical physicists Hartree (1928a, 1928b) and Fock (1930) to deal with the quantum mechanical problem of many-particle atomic and molecular systems. Initially developed
Quantum mechanics and mixed quantum mechanics/molecular mechanics simulations of model nerve agents with acetylcholinesterase
β Scribed by M.M. Hurley; J.B. Wright; G.H. Lushington; W.E. White
- Publisher
- Springer
- Year
- 2003
- Tongue
- English
- Weight
- 246 KB
- Volume
- 109
- Category
- Article
- ISSN
- 1432-2234
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