Re: [Wien] a possible bug in hamilt.F (local-local part)

Envoyé de mon iPad Le 3 mai 2013 à 00:52, Peter Blaha pbl...@theochem.tuwien.ac.at a écrit : Hi, I'm not sure I understand your message correctly. You are saying in WIEN2k_06 there was this error and the first local orbital was not taken into account properly ??? What about

Re: [Wien] a possible bug in hamilt.F (local-local part)

Envoyé de mon iPad Le 3 mai 2013 à 00:52, Peter Blaha pbl...@theochem.tuwien.ac.at a écrit : Hi, I'm not sure I understand your message correctly. You are saying in WIEN2k_06 there was this error and the first local orbital was not taken into account properly ??? What about