Computational data related to: "Exploration and Optimization in Crystal Structure Prediction: Combining Basin Hopping with Quasi-Random Sampling"

Name: Computational data related to: "Exploration and Optimization in Crystal Structure Prediction: Combining Basin Hopping with Quasi-Random Sampling"
Creator: University of Southampton
Published: 2021-02-01T17:13:14+08:00

DataCite Commons2021-02-01 更新2025-04-17 收录

晶体结构预测

计算材料优化

数据链接：

http://eprints.soton.ac.uk/id/eprint/446227 数据链接链接失效反馈

官方服务：

资源简介：

Computational data related to landscapes of predicted crystal structures reported in: Exploration and Optimization in Crystal Structure Prediction: Combining Basin Hopping with Quasi-Random Sampling

提供机构：

University of Southampton

创建时间：

2021-02-01