Problem with berry curvature on a magnetically doped surface

Infant83 / VASPBERRY

Berry curvature and Chern number calculations with the output (WAVECAR) of VASP code

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Problem with berry curvature on a magnetically doped surface #3

Closed anhph closed 3 years ago

anhph commented 5 years ago

Hi,

I'm trying to calculate the Berry curvature on a ferromagnetically magnetically doped surface (slab structure) with spin-orbit, but I have been getting this error !!! ne(K) /= ne(K') !!!
Any help would be appreciated. Thanks, Anh

Infant83 commented 4 years ago

I think this is because your system is "probably" metallic. You may specify the number of electrons in your system by hand adding "-ne" option into your command line. Have a look the help page first, by -h option.