Ab initio calculations and high P-T experiments on iron, iron alloys and other materials: hcp-Fe-Si-S-C elasticity 2000 K
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下载链接：
https://rdr.ucl.ac.uk/articles/Ab_initio_calculations_and_high_P-T_experiments_on_iron_iron_alloys_and_other_materials_hcp-Fe-Si-S-C_elasticity_2000_K/10763261/1
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资源简介：
The folder includes the relaxation calculations for the hcp-Fe-Si-C alloy under NPT ensemble at 360 GPa and 2000 K. Ab initio molecular dynamics were performed by using the Vienna Ab initio Simulation Package. <br>
提供机构：
University College London
创建时间：
2019-11-27
