Generalizability of Graph Neural Network Force Fields for Predicting Solid-State Properties

16 September 2024

Papers citing "Generalizability of Graph Neural Network Force Fields for Predicting Solid-State Properties"

3 / 3 papers shown

Title
Evaluating the Transferability of Machine-Learned Force Fields for Material Property Modeling Shaswat Mohanty S. Yoo K. Kang W. Cai 54 2 0 10 Jan 2023
Graph Neural Networks Accelerated Molecular Dynamics Zijie Li Kazem Meidani Prakarsh Yadav A. Farimani GNN AI4CE 56 56 0 06 Dec 2021
Learning Large-Time-Step Molecular Dynamics with Graph Neural Networks Tian Zheng Weihao Gao Chong-Jun Wang AI4CE 52 4 0 30 Nov 2021