Ab initio calculations and high P-T experiments on iron, iron alloys and othe...
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https://b2find.eudat.eu/dataset/0f1905db-21a7-5c21-b9d5-052b05721bed
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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...
