Frequently-Asked Questions ========================== wien2k: FERMI ERROR when running `x lapw2 -almd -band` ------------------------------------------------------ In some versions of Wien2k, there is a problem in running `x lapw2 -almd -band`. A hack solution is as follows: 1) `x lapw1 -band` 2) edit in2 file: replace 'TOT' with 'QTL', 'TETRA' with 'ROOT' 3) `x lapw2 -almd -band` 4) `dmftproj -band` (add the fermi energy to file, it can be found by running `grep :FER *.scf`) How do I do ..this..? --------------------- This is how you do this. Why is my calculation not working? ---------------------------------- Are you running in the right shell?