RuO2 (100) and (410) surface reconstructions
收藏DataCite Commons2023-08-03 更新2024-08-18 收录
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https://figshare.com/articles/dataset/RuO2_100_and_410_surface_reconstructions/23833941
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资源简介：
Final RuO2 training set and global minimum reconstructions for RuO2(100) and (410) surfaces.<br>The reference method: Quantum Espresso, RPBE, SG15 optimized norm-conserving Vanderbilt pseudopotential.MLPP: Gaussian Approximation Potential.For more details, see the respective publication by Yonghyuk Lee et al.
提供机构：
figshare
创建时间：
2023-08-03
