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Geometry-enhanced pretraining on interatomic potentials.
Taoyong Cui
Chenyu Tang
Mao Su
Shufei Zhang
Yuqiang Li
Lei Bai
Yuhan Dong
Xingao Gong
Wanli Ouyang
Published in:
Nat. Mac. Intell. (2024)
Keyphrases
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three dimensional
high order
higher order
geometric structure
social networks
machine learning
genetic algorithm
optimal solution
multiresolution
multi view
potential functions