On Fri, January 25, 2008 06:44, Lazaro Calderin wrote: > [cut] Oh, and you have a ghost in the s component at ~ -4 rydberg and one in the p channel at ~ 0.8 Ry. It means that your rcloc is probably far too small.
Even if the test works in ld1 this pseudo will never be usable in pw -- Lorenzo Paulatto SISSA & DEMOCRITOS (Trieste) +39 040 3787 511 http://people.sissa.it/~paulatto/ ---------------------------------------------------------------- SISSA Webmail https://webmail.sissa.it/ Powered by SquirrelMail http://www.squirrelmail.org/
