First Principles Neural Network Potentials for Reactive Simulations of Large Molecular and Condensed Systems.
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ANI-1, A data set of 20 million calculated off-equilibrium conformations for organic molecules.A neural-network potential through charge equilibration for WS2: From clusters to sheets.High-dimensional neural network potentials for solvation: The case of protonated water clusters in helium.The TensorMol-0.1 model chemistry: a neural network augmented with long-range physics.
P2860
First Principles Neural Network Potentials for Reactive Simulations of Large Molecular and Condensed Systems.
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2017 nî lūn-bûn
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2017年の論文
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2017年論文
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2017年論文
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2017年論文
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2017年論文
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2017年论文
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2017年论文
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2017年论文
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name
First Principles Neural Networ ...... lecular and Condensed Systems.
@en
type
label
First Principles Neural Networ ...... lecular and Condensed Systems.
@en
prefLabel
First Principles Neural Networ ...... lecular and Condensed Systems.
@en
P2860
P356
P1476
First Principles Neural Networ ...... lecular and Condensed Systems.
@en
P2093
Jörg Behler
P2860
P304
12828-12840
P356
10.1002/ANIE.201703114
P407
P50
P577
2017-05-18T00:00:00Z