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"EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields ..."

Vaibhav Bihani et al. (2023)

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DOI: 10.48550/ARXIV.2310.02428

access: open

type: Informal or Other Publication

metadata version: 2024-10-06

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  - journals/corr/abs-2310-02428
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  - https://dblp.org/rec/journals/corr/abs-2310-02428
Vaibhav Bihani, Utkarsh Pratiush, Sajid Mannan, Tao Du, Zhimin Chen, Santiago Miret, Matthieu Micoulaut, Morten M. Smedskjaer, Sayan Ranu, N. M. Anoop Krishnan:
EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations. CoRR abs/2310.02428 (2023)

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