DFT Accurate Interatomic Potential for Molten NaCl from...

The Journal of Physical Chemistry C 2020 / 11 Vol. 124; Iss. 47

DFT Accurate Interatomic Potential for Molten NaCl from Machine Learning

Tovey, Samuel, Narayanan Krishnamoorthy, Anand, Sivaraman, Ganesh, Guo, Jicheng, Benmore, Chris, Heuer, Andreas, Holm, Christian
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Volume:
124
Journal:
The Journal of Physical Chemistry C
DOI:
10.1021/acs.jpcc.0c08870
Date:
November, 2020
File:
PDF, 1.50 MB
2020
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