On Mon, Sep 3, 2012 at 2:30 PM, Romeda Azeen <romeda_8 at yahoo.com> wrote: > Dear PW Forum, > I have a question about of pseudopotential of Hafnium Metal. > I want to do some computation on HfV2 under USPP (Vanderbilt's scheme), but > I can't find any available USPP of Hafnium. > What should I do,will you give me some hints/assistant?
if you can't find the pseudopotential, you have to either make it yourself or find a way to convince somebody to do it for you. since generation of pseudopotentials can be tedious and is generally a rather thankless profession, you may need some very good arguments for the latter. cheers, axel. > Thanks in advance. > > -- > Romeda Azeen > Bhavnagar University Bhavnagar 364002 Gujarat, India. > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > -- Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0 International Centre for Theoretical Physics, Trieste. Italy.