Constrained MD using a microcanonical ensemble: Difference between revisions
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== Used INCAR Tags == | == Used INCAR Tags == | ||
{{TAG|ANDERSEN_PROB}},{{TAG|EDIFF}},{{TAG|EDIFFG}},{{TAG|ENMAX}},{{TAG|IBRION}},{{TAG|ISMEAR}},{{TAG|MDALGO}},{{TAG|NSW}},{{TAG|POTIM}},{{TAG|SIGMA}},{{TAG|SYSTEM}},{{TAG|TEBEG}},{{TAG|TEEND}} | {{TAG|ANDERSEN_PROB}}, {{TAG|EDIFF}}, {{TAG|EDIFFG}}, {{TAG|ENMAX}},{{TAG|IBRION}}, {{TAG|ISMEAR}},{{TAG|MDALGO}}, {{TAG|NSW}},{{TAG|POTIM}}, {{TAG|SIGMA}}, {{TAG|SYSTEM}}, {{TAG|TEBEG}},{{TAG|TEEND}} | ||
== Download == | == Download == | ||