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by JunqingXu
Sun Apr 14, 2019 2:51 am
Forum: Ground state
Topic: Strange spin-component DOS with spin-orbit coupling
Replies: 0
Views: 3020

Strange spin-component DOS with spin-orbit coupling

Dear developers, I found that with spin-orbit coupling (nspinor==2) and prtdos==5, the sigma_z projected DOS of non-magnetic system – silicon is non-zero (see figure below). Is it a bug? Can anyone help to figure out this issue? SpinSpin_DOS.jpg I put my input file here. acell 3*10.263 rprim 0.0 0.5...