BAND tutorial 1: with a grain of salt
A video walk-through of the first tutorial for using SCM's BAND periodic-DFT program
http://www.scm.com/Doc/Doc2009.01/BANDGUI/BANDGUI_tutorial/page4.html
This tutorial will teach you how to: * define the geometry of a NaCl crystal * run the calculation * view the band structure * view an orbital for a particular band and k-point * view the (partial) density of states * view the deformation density * view the atomic charges
Link to this comment:
All Comments (0)