DFT output files for 'Control of Uniaxial Negative Thermal Expansion in Layered Perovskites by Tuning Layer Thickness'
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https://figshare.com/articles/dataset/DFT_output_files_for_Control_of_Uniaxial_Negative_Thermal_Expansion_in_Layered_Perovskites_by_Tuning_Layer_Thickness_/6729287
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资源简介：
Output files with .castep extension for all DFT calculations related to the manuscript 'Control of Uniaxial Negative Thermal Expansion in Layered Perovskites by Tuning Layer Thickness' performed using CASTEP v7.0.3.
创建时间：
2018-07-02
