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Title: Paving the way for cristobalite TiO2 and GeO2 attainable under moderate tensile stress: A DFT study of transformation paths and activation barriers in cristobalite-rutile transformations of MO2 (M = Si, Ge, Ti)
Authors:
;
Award ID(s):
1634448 1463974
Publication Date:
NSF-PAR ID:
10196501
Journal Name:
Computational Materials Science
Volume:
170
Issue:
C
Page Range or eLocation-ID:
109170
ISSN:
0927-0256
Sponsoring Org:
National Science Foundation
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