Computational data for: "Machine learned potentials by active learning from organic crystal structure prediction landscapes'

Name: Computational data for: "Machine learned potentials by active learning from organic crystal structure prediction landscapes'
Creator: University of Southampton
Published: 2024-07-15 12:47:18
License: 暂无描述

DataCite Commons2024-07-15 更新2025-04-17 收录

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https://eprints.soton.ac.uk/486210/

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资源简介：

Computational data related to landscapes of predicted crystal structures and neural network potentials reported in publication 'Machine Learned Potentials by Active Learning from Organic Crystal Structure Prediction Landscapes'. in press Journal of Physical Chemistry A

提供机构：

University of Southampton

创建时间：

2024-01-15