Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies
- Authors:
- Publication Date:
- Sponsoring Org.:
- USDOE
- OSTI Identifier:
- 1104176
- Resource Type:
- Publisher's Accepted Manuscript
- Journal Name:
- Physical Review B
- Additional Journal Information:
- Journal Name: Physical Review B Journal Volume: 85 Journal Issue: 11; Journal ID: ISSN 1098-0121
- Publisher:
- American Physical Society
- Country of Publication:
- United States
- Language:
- English
Citation Formats
Stevanović, Vladan, Lany, Stephan, Zhang, Xiuwen, and Zunger, Alex. Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies. United States: N. p., 2012.
Web. doi:10.1103/PhysRevB.85.115104.
Stevanović, Vladan, Lany, Stephan, Zhang, Xiuwen, & Zunger, Alex. Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies. United States. https://doi.org/10.1103/PhysRevB.85.115104
Stevanović, Vladan, Lany, Stephan, Zhang, Xiuwen, and Zunger, Alex. Wed .
"Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies". United States. https://doi.org/10.1103/PhysRevB.85.115104.
@article{osti_1104176,
title = {Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies},
author = {Stevanović, Vladan and Lany, Stephan and Zhang, Xiuwen and Zunger, Alex},
abstractNote = {},
doi = {10.1103/PhysRevB.85.115104},
journal = {Physical Review B},
number = 11,
volume = 85,
place = {United States},
year = {Wed Mar 07 00:00:00 EST 2012},
month = {Wed Mar 07 00:00:00 EST 2012}
}
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https://doi.org/10.1103/PhysRevB.85.115104
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