DP-GEN: a concurrent learning platform for the generation of reliable deep learning based potential energy models

DOI10.1016/j.cpc.2020.107206zbMath1522.81011arXiv1910.12690OpenAlexW3006005697WikidataQ84727297 ScholiaQ84727297MaRDI QIDQ6044795

Wei-Jie Chen, Haidi Wang, Han Wang, Yuzhi Zhang, E. Weinan, Linfeng Zhang, Jinzhe Zeng

Publication date: 22 May 2023

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/1910.12690

zbMATH Keywords

deep learningconcurrent learningmany-body potential energy

Mathematics Subject Classification ID

Artificial neural networks and deep learning (68T07) Computational methods for problems pertaining to quantum theory (81-08) Atomic physics (81V45) Many-body theory; quantum Hall effect (81V70) Molecular physics (81V55) Quantum discord (81P43)

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Cites Work

• Fast parallel algorithms for short-range molecular dynamics
• Deep Potential: A General Representation of a Many-Body Potential Energy Surface