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Title: First-principles investigation of phase stability in the Mg-Sc binary alloy

Authors:
;
Publication Date:
Grant/Contract Number:
SC0008637; AC02-05CH11231
Type:
Publisher's Accepted Manuscript
Journal Name:
Physical Review B
Additional Journal Information:
Journal Name: Physical Review B Journal Volume: 95 Journal Issue: 21; Journal ID: ISSN 2469-9950
Publisher:
American Physical Society
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1361568

Natarajan, Anirudh Raju, and Van der Ven, Anton. First-principles investigation of phase stability in the Mg-Sc binary alloy. United States: N. p., Web. doi:10.1103/PhysRevB.95.214107.
Natarajan, Anirudh Raju, & Van der Ven, Anton. First-principles investigation of phase stability in the Mg-Sc binary alloy. United States. doi:10.1103/PhysRevB.95.214107.
Natarajan, Anirudh Raju, and Van der Ven, Anton. 2017. "First-principles investigation of phase stability in the Mg-Sc binary alloy". United States. doi:10.1103/PhysRevB.95.214107.
@article{osti_1361568,
title = {First-principles investigation of phase stability in the Mg-Sc binary alloy},
author = {Natarajan, Anirudh Raju and Van der Ven, Anton},
abstractNote = {},
doi = {10.1103/PhysRevB.95.214107},
journal = {Physical Review B},
number = 21,
volume = 95,
place = {United States},
year = {2017},
month = {6}
}

Works referenced in this record:

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  • DOI: 10.1103/PhysRevLett.77.3865

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
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Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
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Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
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Ab initiomolecular dynamics for liquid metals
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