Thermochemical Ranking and Dynamic Stability of TeO2 Polymorphs from Ab Initio Theory
Author:
Affiliation:
1. Institute of Inorganic Chemistry and ‡Jülich−Aachen Research Alliance (JARA-HPC), RWTH Aachen University, Landoltweg 1, 52056 Aachen, Germany
Publisher
American Chemical Society (ACS)
Subject
Condensed Matter Physics,General Materials Science,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/cg401822g
Reference50 articles.
1. Polymorphism − A Perspective
2. Challenges in Modeling Materials Properties Without Experimental Input
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4. Computational Chemistry of Solid State Materials
5. Ab Initio Thermochemistry of Solid-State Materials
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