𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Glass transition of hard sphere systems: Molecular dynamics and density functional theory

✍ Scribed by Kim, Kang; Munakata, Toyonori

Book ID
111688538
Publisher
The American Physical Society
Year
2003
Tongue
English
Weight
63 KB
Volume
68
Category
Article
ISSN
1063-651X

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Density Functional Theory-Based Molecula
Density Functional Theory-Based Molecular Dynamics of Biological Systems
✍ Carloni, Paolo πŸ“‚ Article πŸ“… 2002 πŸ› John Wiley and Sons 🌐 English βš– 221 KB πŸ‘ 1 views

Density functional theory based molecular dynamics (DFT-MD), play an increasingly important role for the modeling of biological systems. Here we outline the principles of the DFT-MD method. Subsequently, we present selected applications in nucleic acid and enzyme chemistry, which are meant to illust

Molecular dynamics and Enskog theory cal
Molecular dynamics and Enskog theory calculation of shock profiles in a dense hard sphere gas
✍ A. Frezzotti πŸ“‚ Article πŸ“… 1998 πŸ› Elsevier Science 🌐 English βš– 574 KB

Normal shpck.proflles~in a d~ hard sphere gas are obtained by solving numerically the Enslcog kinetic equation. The res'ults 6~the Enskog theory are compared with "exact" shock profiles obtained from molecular dynamics symulations. It is shown that, at least in the range of the flow pexameters exami