We review principles of non-Hamiltonian statistical mechanics and present a new set of equations and integration algorithm for isothermal-isobaric dynamics. The chief advantage of the present scheme is that it is somewhat simpler than previous methods. We perform numerical simulations to test the ac
✦ LIBER ✦
Simple exact test for well-known molecular dynamics algorithms
✍ Scribed by G.D.Venneri William; William G Hoover
- Publisher
- Elsevier Science
- Year
- 1987
- Tongue
- English
- Weight
- 502 KB
- Volume
- 73
- Category
- Article
- ISSN
- 0021-9991
No coin nor oath required. For personal study only.
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