How evolutionary crystal structure prediction works--and why.

By Artem R. Oganov, Andriy O. Lyakhov, Mario Valle. Accounts of Chemical Research, 2011

1,065 citations recorded by the source corpus.

Subfields: Computational Theory and Mathematics, Materials Chemistry, Physical and Theoretical Chemistry

View Paper: https://www.semanticscholar.org/paper/45bd1f662a7c2ac184ebd8cad1df56fd89ba1ca5

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In Computational Theory and Mathematics

1. Bo Xu
2. Zhisheng Zhao
3. Yongjun Tian

In Materials Chemistry

1. Bo Xu
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3. Yongjun Tian

In Physical and Theoretical Chemistry

1. Bo Xu
2. Zhisheng Zhao
3. Yongjun Tian

Citations in the corpus

• Microscopic theory of hardness and design of novel superhard crystals (2012, methodology): “Therefore, the updated model combined with the evolution crystal structure prediction algorithm, USPEX [62,63], provides a way of systematic discovery of new hard and superhard materials.”