On 21/01/15 09:05, Winfred Mulwa wrote: > > Dear all, > I want to run a calculation using Ti norm conserving LDA pseudo potentials > which have not been converted from another format. Somebody to help me , > how do i get this peudopotentials and they are not available in > quantum espresso. > Kind regards
There are two such pseudopotentials here: <http://www.quantum-espresso.org/pseudo-search-results/?el_id=22&unp_id=7&fun_id=10&colum_k&origin_id> One includes semi-core states, the other does not. kind regards -- Dr. Lorenzo Paulatto IdR @ IMPMC -- CNRS & Université Paris 6 phone: +33 (0)1 44275 084 / skype: paulatz www: http://www-int.impmc.upmc.fr/~paulatto/ mail: 23-24/4é16 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05 _______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
