Elastic properties, lattice dynamics and structural transitions in molybdenum at high pressures

The structural phase transitions in molybdenum under pressures are investigated on the basis of first principle analysis of elastic constants behavior and phonon dispersions. The definition of the effective elastic constants of nth order (n = 2), governing the elastic properties of a loaded crystal,...

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Bibliographic Details
Main Authors: Krasilnikov, O., Belov, M., Lugovskoy, Andrey, Mosyagin, I., Vekilov, Y.
Format: Journal Article
Published: 2014
Online Access:http://hdl.handle.net/20.500.11937/32685