Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
1521795 | Materials Chemistry and Physics | 2014 | 5 Pages |
Abstract
Using classical molecular dynamics applied to crystalline PbF2, we have simulated transitions between cubic and orthorhombic phases and reciprocally. These transitions were induced by pressure and temperature treatments. The orthorhombic phase was evidenced by analysis of different distribution functions and XRD spectra drawn from the ions positions in the simulated samples.
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Authors
A. Monteil, S. Chaussedent, D. Guichaoua,