𝔖 Bobbio Scriptorium
✦   LIBER   ✦

The Photoisomerization Mechanism of Azobenzene: A Semiclassical Simulation of Nonadiabatic Dynamics

✍ Scribed by Cosimo Ciminelli; Giovanni Granucci; Maurizio Persico


Publisher
John Wiley and Sons
Year
2004
Tongue
English
Weight
445 KB
Volume
10
Category
Article
ISSN
0947-6539

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Hybrid molecular dynamics-quantum mechan
✍ Matthew C. Zwier; Justin M. Shorb; Brent P. Krueger πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 369 KB

## Abstract We have explored the impact of a number of basic simulation parameters on the results of a recently developed hybrid molecular dynamics‐quantum mechanics (MD‐QM) method (Mercer et al., J Phys Chem B 1999, 103, 7720). The method utilizes MD simulations to explore the ground‐state configu

Simulation of the dynamics of depth filt
✍ V. N. Burganos; E. D. Skouras; C. A. Paraskeva; A. C. Payatakes πŸ“‚ Article πŸ“… 2001 πŸ› American Institute of Chemical Engineers 🌐 English βš– 367 KB πŸ‘ 2 views

## Abstract A new simulator for flow of aqueous suspensions and deposition of non‐Brownian particles in granular media can predict the pattern of deposition and concomitant reduction in permeability as functions of depth, time and system parameters. The porous structure of the granular medium repre