Firefly and PC GAMESS-related discussion club

Learn how to ask questions correctly  
We are NATO-free zone

How we can produce wavefunction file for CASINO program?

Amir Nasser Shamkhali

Dear All
I want to use diffusion Monte-Carlo method for excitation energies of transition metals using CASINO program. How we can produce an appropriate wavefunction file for it?
[ Previous ] [ Next ] [ Index ]           Tue Apr 1 '14 12:00pm
[ Reply ] [ Edit ] [ Delete ]           This message read 843 times