The development of the effective potential theory
β Scribed by G.K. Horton; D. Acocella; E.Roger Cowley
- Publisher
- Elsevier Science
- Year
- 1996
- Tongue
- English
- Weight
- 294 KB
- Volume
- 232
- Category
- Article
- ISSN
- 0378-4371
No coin nor oath required. For personal study only.
β¦ Synopsis
Recent progress in lattice dynamics, based on the path integral formulation of statistical mechanics, is reviewed from a historical perspective. The improved effective potential theory is described and a detailed application to solid Ne is presented. The work is based on a nearest neighbor Mie-Lennard-Jones potential and contact is made with earlier theories based on the same potential.
π SIMILAR VOLUMES
## Abstract The Effective Fragment Potential (EFP) method for solvation decreases the cost of a fully quantum mechanical calculation by dividing a chemical system into an __ab initio__ region that contains the solute plus some number of solvent molecules, if desired, and an βeffective fragmentβ reg