Dataset for "Mobility and Sintering of Silica-Supported Platinum Clusters via Reactive Neural Network Potentials"
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资源简介：
NNP training datasets, electronic structure data, molecular dynamics trajectories, charge analysis data,diffusion analysis data, nudged elastic band trajectories, relevant scripts for running simulations, and rawdata for manuscript/ESI tables
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Zenodo创建时间：
2025-07-18
