Probably nobody has ever tried it with a magnetic field in case.inorb.
Move cse.inorb to some other name before x symmetso and create it manually (Just check, if the number of non-equivalent atoms has changed or not).
Am 08.11.2015 um 20:38 schrieb Jing-Han Chen:
Dear All I am trying to calculate the effect of spin-orbit coupling while the external magnetic field is specified by ORB package. However, it continues to give an error of reading the case.inorb during "x symmetso", one of initso_lapw step. I wonder whether SOC is actually not compatible with the nmod=3 ORB. Did anyone have the experience about this?
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