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Title: Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U

Authors:
 [1]; ORCiD logo [1]
  1. Department of Chemical Engineering and ‡Department of Mechanical Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, United States
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
OSTI Identifier:
1418190
Grant/Contract Number:
SC0018096
Resource Type:
Journal Article: Published Article
Journal Name:
Journal of Chemical Theory and Computation
Additional Journal Information:
Journal Volume: 14; Journal Issue: 2; Related Information: CHORUS Timestamp: 2018-02-13 04:15:15; Journal ID: ISSN 1549-9618
Publisher:
American Chemical Society
Country of Publication:
United States
Language:
English

Citation Formats

Zhao, Qing, and Kulik, Heather J. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U. United States: N. p., 2018. Web. doi:10.1021/acs.jctc.7b01061.
Zhao, Qing, & Kulik, Heather J. Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U. United States. doi:10.1021/acs.jctc.7b01061.
Zhao, Qing, and Kulik, Heather J. Tue . "Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U". United States. doi:10.1021/acs.jctc.7b01061.
@article{osti_1418190,
title = {Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U},
author = {Zhao, Qing and Kulik, Heather J.},
abstractNote = {},
doi = {10.1021/acs.jctc.7b01061},
journal = {Journal of Chemical Theory and Computation},
number = 2,
volume = 14,
place = {United States},
year = {Tue Jan 16 00:00:00 EST 2018},
month = {Tue Jan 16 00:00:00 EST 2018}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record at 10.1021/acs.jctc.7b01061

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