๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Stilbene isomerization dynamics on multidimensional potential energy surface. Molecular dynamics simulation

โœ Scribed by Valentin D. Vachev; John H. Frederick; Boris A. Grishanin; Victor N. Zadkov; Nikolai I. Koroteev


Publisher
Elsevier Science
Year
1993
Tongue
English
Weight
756 KB
Volume
215
Category
Article
ISSN
0009-2614

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


An aspect of molecular dynamics on the C
โœ Koichi Yamashita; Akitomo Tachibana; Tokio Yamabe; Kenichi Fukui ๐Ÿ“‚ Article ๐Ÿ“… 1980 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 324 KB

A new method for the gradient of the CI adiabatic potential using an exact analytical formula has been developed-Some dynamxal aspects of formaldehyde are investigated as a prehninary exampie of the application of this me&ad.

Molecular Dynamics Simulation of the Ads
โœ Maria Darvas; Dr. Sylvain Picaud; Prof. Pal Jedlovszky ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 504 KB

## Abstract The adsorption properties of oxalic acid molecules on the surface of hexagonal ice are investigated by means of molecular dynamics simulations performed at tropospheric temperatures. Although the oxalic acidโ€“water interaction is strong at low coverage, due to the possible formation of a