Re: [Wien] K-points for Band structure

The format of the xcrysden.klist file that you attached seems not fine. It looks like you might have selected in the top menu of XCrySDen Tools-k-path Selection and saved it in .kpf format. You need to click the Generate k-mesh using XCrysden button in w2web or select in the top menu of

Re: [Wien] K-points for Band structure

Thanks Alpa . I will follow your suggestion and reply back to you If any problem occurs . On Mon, Jul 20, 2015 at 11:10 AM, Alpa Dashora dashora...@gmail.com wrote: Dear Paresh, Save the xcrysden kpoint file as xcrysden.klist. Then in w2web, task section, select band structure window. In