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This content will become publicly available on August 31, 2015

Title: Investigating the Energetic Ordering of Stable and Metastable TiO 2 Polymorphs Using DFT+ U and Hybrid Functionals

Authors:
 [1] ;  [1]
  1. Department of Materials Science and Engineering and ‡Department of Chemical Engineering, Carnegie Mellon University, 5000 Forbes Ave., Pittsburgh, Pennsylvania 15213, United States
Publication Date:
OSTI Identifier:
1234078
Grant/Contract Number:
SC0004031
Type:
Published Article
Journal Name:
Journal of Physical Chemistry. C
Additional Journal Information:
Journal Volume: 119; Journal Issue: 36; Related Information: CHORUS Timestamp: 2017-11-02 16:13:28; Journal ID: ISSN 1932-7447
Publisher:
American Chemical Society
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English