Articles with "transitions gallium" as a keyword



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Temperature effects on the structural phase transitions of gallium phosphide

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Published in 2019 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2019.02.010

Abstract: Abstract In this work, we study the structural phase transitions of gallium phosphide (GaP), witha combination of molecular dynamics simulations (MD) and ab initio calculations based on density functional theory (DFT) with vibrational corrections within… read more here.

Keywords: transitions gallium; phase transitions; structural phase; gallium phosphide ... See more keywords