Re: [Wien] Problem with x w2w -so -up (wien2wannier)

On 07/21/2016 09:51 AM, Wen Fong Goh wrote: > Hi Elias, I have tried out the current development version and it > reports no error, except it asked for case.inwfup and dn, which I assume > can be copied from case.inwf. So do you think the current wien2k package > should be updated with this wien2wa

[Wien] Electron Density

Dear Wien2k developers I want to calculate the electron density on a Hexagonal supercell of Bi2Se3, with wien version 14.2 . Typically , I select one layer perpendicular c-crystallography and accomplish El.Dense completely, finally select the “rhoplot” and tick “3D-plot” to draw 3D-electron densi

[Wien] Help

Dear Wien2k and Boltztrap users and Developers Greetings from me. Plz help me. I am working with Boltztrap using Wien2k. I used following steps 1. SCF calculations have been converged with wien2k 2. I copied case.struct and case.energy fro wien2k working directory of compound and pest into GdFe2 di