𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Simulation of structural phase transition in NaNO3and CaCO3

✍ Scribed by Jianjun Liu; C.-G. Duan; M. M. Ossowski; W. N. Mei; R. W. Smith; J. R. Hardy


Publisher
Springer-Verlag
Year
2001
Tongue
English
Weight
120 KB
Volume
28
Category
Article
ISSN
0342-1791

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Thermodynamics of CaCO3phase transitions
✍ G. Wolf; J. Lerchner; H. Schmidt; H. GamsjΓ€ger; E. KΓΆnigsberger; P. Schmidt πŸ“‚ Article πŸ“… 1996 πŸ› Springer Netherlands 🌐 English βš– 325 KB
Molecular Dynamics Simulation of Structu
✍ Jianjun Liu; Chun-gang Duan; M.M. Ossowski; W.N. Mei; R.W. Smith; J.R. Hardy πŸ“‚ Article πŸ“… 2001 πŸ› Elsevier Science 🌐 English βš– 398 KB

Structural phase transitions in RbNO 3 and CsNO 3 are studied by molecular dynamics. The simulations are based on the parameter-free potentials calculated from the Gordon+Kim modi5ed electron gas formalism, extended to ionic molecular crystals. The microscopic mechanism of the structural phase trans