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Title: Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids

Authors:
; ; ; ; ; ; ; ; ; ;
Publication Date:
Grant/Contract Number:
AC02-05CH11231; EDCBEE
Type:
Publisher's Accepted Manuscript
Journal Name:
Physical Review Materials
Additional Journal Information:
Journal Name: Physical Review Materials Journal Volume: 1 Journal Issue: 1; Journal ID: ISSN 2475-9953
Publisher:
American Physical Society
Sponsoring Org:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Country of Publication:
United States
Language:
English
OSTI Identifier:
1364217

Toher, Cormac, Oses, Corey, Plata, Jose J., Hicks, David, Rose, Frisco, Levy, Ohad, de Jong, Maarten, Asta, Mark, Fornari, Marco, Buongiorno Nardelli, Marco, and Curtarolo, Stefano. Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids. United States: N. p., Web. doi:10.1103/PhysRevMaterials.1.015401.
Toher, Cormac, Oses, Corey, Plata, Jose J., Hicks, David, Rose, Frisco, Levy, Ohad, de Jong, Maarten, Asta, Mark, Fornari, Marco, Buongiorno Nardelli, Marco, & Curtarolo, Stefano. Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids. United States. doi:10.1103/PhysRevMaterials.1.015401.
Toher, Cormac, Oses, Corey, Plata, Jose J., Hicks, David, Rose, Frisco, Levy, Ohad, de Jong, Maarten, Asta, Mark, Fornari, Marco, Buongiorno Nardelli, Marco, and Curtarolo, Stefano. 2017. "Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids". United States. doi:10.1103/PhysRevMaterials.1.015401.
@article{osti_1364217,
title = {Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids},
author = {Toher, Cormac and Oses, Corey and Plata, Jose J. and Hicks, David and Rose, Frisco and Levy, Ohad and de Jong, Maarten and Asta, Mark and Fornari, Marco and Buongiorno Nardelli, Marco and Curtarolo, Stefano},
abstractNote = {},
doi = {10.1103/PhysRevMaterials.1.015401},
journal = {Physical Review Materials},
number = 1,
volume = 1,
place = {United States},
year = {2017},
month = {6}
}

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First-Principles Determination of Ultrahigh Thermal Conductivity of Boron Arsenide: A Competitor for Diamond?
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