Hydrogen-induced_insulating_state_SmNiO3
收藏DataCite Commons2024-03-28 更新2024-07-13 收录
下载链接:
https://materials.colabfit.org/id/DS_r1sl5dye35kg_0
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资源简介:
A dataset of DFT-calculated energies created to investigate the effect of hydrogen doping on the crystal structure and the electronic state in SmNiO3.Configuration sets include sets for apically and side-bonded hydrogen atoms for 1-9 hydrogen atoms.
提供机构:
ColabFit
创建时间:
2024-03-28



