๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Fluctuation formulas in molecular-dynamics simulations with the weak coupling heat bath

โœ Scribed by Morishita, Tetsuya


Book ID
121090788
Publisher
American Institute of Physics
Year
2000
Tongue
English
Weight
496 KB
Volume
113
Category
Article
ISSN
0021-9606

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Use of molecular dynamics simulations wi
โœ Rolf Eggenberger; Stefan Gerber; Hanspeter Huber; Debra Searles; Marc Welker ๐Ÿ“‚ Article ๐Ÿ“… 1993 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 757 KB

The deuterium quadrupole coupling constant and asymmetry parameter in heavy water were determined using ab initio SCF calculations. Snapshots from a molecular dynamics simulation were used to give liquid water cluster configurations and the influence of simulation parameters on the quadrupole coupli