Hello, I wish to compare between lsda calculation with a full relativistic one, since they involve two different pseudopotentials. What restrictions should I put in the spin-orbit calculation in order to make it be equivalent to lsda? Thanks, Eitan Eidelstein, NRCN, Israel.
_______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
