Dataset for Co-substituted BiFeO3: thermodynamic, electronic and ferroelectric properties from first principles
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下载链接：
https://zenodo.org/record/5720627
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资源简介：
Data files related to the publication Co-substituted BiFeO3: thermodynamic, electronic and ferroelectric properties from first principles. The paper is yet to be submitted. The dataset includes, (i) VASP input/output files for electronic structure and polarization calculations and (ii) GULP files for the thermodynamic study.
创建时间：
2021-11-27
