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High-dimensional potential energy surfaces for molecular simulations: from empiricism to machine learning
High-dimensional potential energy surfaces for molecular simulations: from empiricism to machine learning
2020
Oliver T. Unke
Debasish Koner
Sarbani Patra
Silvan Käser
Markus Meuwly
Keywords:
Empiricism
Potential energy
high dimensional
Computational science
Computer science
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