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Crystal structure prediction using ab initio evolutionary techniques: Principles and applications
Crystal structure prediction using ab initio evolutionary techniques: Principles and applications
Jun 28, 2006
1 min read
outgoing-citations
Authors
Artem R. Oganov
Colin W. Glass
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Colin W. Glass
Artem R. Oganov
Discovery of new high-pressure phases – integrating high-throughput DFT simulations, graph neural networks, and active learning