最終更新 2 years ago

yuanpeng's Avatar yuanpeng revised this gist 2 years ago. Go to revision

1 file changed, 1 insertion

rmc2cif(file created)

@@ -0,0 +1 @@
1 + data2config -noannotate -order "[Ga P O]" -supercell "[1 1 1]" -cif gapo4_xray.rmc6f
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