On Tuesday, February 28, 2017 10:28:47 PM CET project way wrote: > here are scf and nscf codes >
Hello, your inputs work perfectly for me with version 5.4 and 6.0 of the code. Are you running the nscf part with the same number of CPUs as the scf one? -- Dr. Lorenzo Paulatto IdR @ IMPMC -- CNRS & Université Paris 6 phone: +33 (0)1 442 79822 / skype: paulatz www: http://www-int.impmc.upmc.fr/~paulatto/ mail: 23-24/423 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
