Phase comparison and equation of state for Ta2O5

Tantalum pentoxide (Ta2O5) is among the most technologically useful heavy transition metal oxides. Unfortunately, its crystal structure is the subject of long-standing and unresolved disagreement. Among other consequences, this uncertainty has made it impossible to formulate a robust high pressure e...

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Bibliographic Details
Published inJournal of physics. Condensed matter Vol. 36; no. 27
Main Authors Brennan, Matthew C, Rehn, Daniel A, Huston, Larissa Q, Sturtevant, Blake T
Format Journal Article
LanguageEnglish
Published United States IOP Publishing 05.04.2024
Subjects
CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY
DFT
equation of state
high pressure
phase stability
Ta2O5
tantalum pentoxide
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