𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Crystallisation and glass formation in liquid lead: a molecular dynamics study

✍ Scribed by J. Rybicki; R. Laskowski; S. Feliziani


Publisher
Elsevier Science
Year
1996
Tongue
English
Weight
322 KB
Volume
97
Category
Article
ISSN
0010-4655

No coin nor oath required. For personal study only.

✦ Synopsis


The molecular dynamics (MD) simulations of crystallisation and glass formation in liquid lead have been performed. Two series of calculations are presented. 1. Isochoric quenches down to 1 K of liquid densified and rarefied lead at various cooling rates; 2. Isothermal (at 600K) compression and decompression at various compression rates. The resulting structures at 1K are analysed within the stochastic geometry methods. The changes of the potential energy, and of the diffusion coefficient during the pressure induced solidification are discussed.


πŸ“œ SIMILAR VOLUMES


A molecular dynamics study of ring forma
✍ W. Smith; A. Wilton; F. MΓΌller-Plathe πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 554 KB

In this exploratory study, the methods of molecular dynamics and Brownian dynamics have been used to investigate the dynamics of ring formation in a simple, idealised, flexible molecule. Particular attention has been paid to the formation and persistence of the bond responsible for ring closure. The

A molecular dynamics study of bubble nuc
✍ Shin-ichi Tsuda; Takashi Tokumasu; Kenjiro Kamijo πŸ“‚ Article πŸ“… 2005 πŸ› John Wiley and Sons 🌐 English βš– 929 KB

The present study investigates bubble nucleation in liquid oxygen with dissolved impurities (nitrogen or helium molecules) using molecular dynamics simulations. When the mole fraction of impurities is 0.05, there is a fundamental difference in the bubble nucleation mechanism between the two dissolve