Data for: Large-Scale DFT Simulations of Defects and Hydrogen Incorporation in PuO2
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资源简介：
This repository hosts computational data supporting the findings in the paper: Large-Scale DFT Simulations of Defects and Hydrogen Incorporation in PuO2, Nabeel Anwar, Robert M. Harker, Mark T. Storr, Marco Molinari and Chris-Kriton Skylaris, Phys. Rev. B, 2024, 109, 224102. Available from https://doi.org/10.1103/PhysRevB.109.224102. UK Ministry of Defence © Crown owned copyright 2024/AWE
创建时间：
2024-10-29
