[Wien] problem in obtaining graphs for charge density and band structure for TiC

Dear Prof. Blaha, It is to bring to your kind notice that while working on TiC problem as per instruction in the user manual we are able to obtain the density of states curves & X ray spectra as given in the manual. However when we tried charge density plots & the band structure diagram, the same a

[Wien] problem in obtaining graphs for charge density and band structure for TiC

Dear Varsha Goyal, Try to calculate charge density with XCrysDen (first download and install from http://xcrysden.org) as described in the User Guide. regards, Yurko 2010/9/7 Varsha Goyal : > Dear Prof. Blaha, > It is to bring to your kind notice that while working on TiC problem as per > instruc