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CMS Group@UNLV |
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Publications |
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arXiv
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Yanxon H, Zagaceta D, Wood B, Zhu Q*(2019)
On Transferability of Machine Learning Force Fields: A Case Study on Silicon
[pdf]
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Fredericks S, Sayre D, Zhu Q*(2019)
PyXtal: a Python Library for Crystal Structure Generation and Symmetry Analysis
[pdf]
Peer Reviewed Papers
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Zagaceta D, Yanxon H, Zhu Q*(2020)
Spectral Neural Network Potentials for Binary Alloys.
J. Appl. Phys., 128, 045113
[pdf]
[arXiv]
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Zhu S-C, Yan X-Z, Liu J, Oganov A. R., Zhu Q*(2020)
A Revisited Mechanism of the Graphite-to-Diamond Transition at High Temperature.
[html]
[pdf]
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Qu J-Y, Zagaceta D, Zhang W-W, Zhu Q*(2020)
High Dielectric Ternary Oxides from Crystal Structure Prediction and High-throughput Screening
Sci. Data, 7, 81
[pdf]
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