Data for: Chapter 4 (Properties of and Charged Defects in ThO2) of the PhD Thesis - Large-Scale Density Functional Theory (DFT) Simulations of Lanthanide and Actinide Oxide Materials

Name: Data for: Chapter 4 (Properties of and Charged Defects in ThO2) of the PhD Thesis - Large-Scale Density Functional Theory (DFT) Simulations of Lanthanide and Actinide Oxide Materials
Creator: doi.org
License: 暂无描述

doi.org2025-01-21 收录

下载链接：

http://doi.org/10.17632/jz726skp6d.3

下载链接

链接失效反馈

官方服务：

资源简介：

This repository hosts computational data supporting the findings in Chapter 4 (Properties and Charged Defects) of the PhD thesis: Large-Scale Density Functional Theory (DFT) Simulations of Lanthanide and Actinide Oxide Materials in ThO2 by Nabeel Anwar. Supervised by Robert M. Harker, Mark T. Storr, Marco Molinari and Chris-Kriton Skylaris. Available from: https://eprints.soton.ac.uk/495909/. UK Ministry of Defence © Crown owned copyright 2024/AWE

本仓库托管支持博士学位论文第四章（性质与带电缺陷）研究发现的计算数据：由Nabeel Anwar进行的钐系和锕系氧化物材料在ThO2中的大规模密度泛函理论（DFT）模拟。指导教师为Robert M. Harker、Mark T. Storr、Marco Molinari和Chris-Kriton Skylaris。数据可从以下链接获取：https://eprints.soton.ac.uk/495909/。版权所有 © 2024 英国国防部/阿韦公司。

提供机构：

doi.org