An implementation of artificial neural-network potentials for atomistic materials simulations: Performance for TiO 2

出版年份 2016 全文链接

标题

作者

关键词

Machine learning, Artificial neural networks, Atomistic simulations, Titanium dioxide (TiO, 2, ), Behler–Parrinello

出版物

Volume 114, Issue -, Pages 135-150

出版商

Elsevier BV

发表日期

2016-01-04

DOI

10.1016/j.commatsci.2015.11.047

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