First-principles interatomic potential of silica applied to molecular dynamics

Physical Review Letters

Volumn 61, Issue 7, 1988, Pages 869-872

  Tsuneyuki, S ^a   Tsukada, M ^a   Aoki, H ^a   Matsui, Y ^b  

^a UNIVERSITY OF TOKYO   (Japan)

^b OKAYAMA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 3743068676     PISSN: 00319007     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevLett.61.869     Document Type: Article

References (24)

1. Crystal structure and elastic constants of β-Mg2SiO4under high pressure simulated from a potential model
2. High Pressure Research in Mineral Physics
3. Gaussian Basis Sets for Molecular Calculation
4. Methods of Electronic Structure Theory
5. The application of external forces to computational models of crystals
6. High-temperature single-crystal study of the cristobalite inversion *
7. Effect of pressure on the lattice parameters of stishovite