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First principles calculation of the Al3U–Si3U pseudobinary fcc phase equilibrium diagram

✍ Scribed by Alonso, Paula R.; Gargano, Pablo H.; Rubiolo, Gerardo H.


Book ID
118267908
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
307 KB
Volume
38
Category
Article
ISSN
0364-5916

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## Abstract The phase boundary between β‐Si~3~N~4~ and γ‐Si~3~N~4~ is investigated at high pressure and high temperature using first‐principles lattice dynamics calculations within the quasi‐harmonic approximation. We find a positive slope of the phase boundary, hence, at higher temperatures it req