You don't have to set them. They have reasonable default values. It is more something you try when your calculation doesn't converge well.
Best Regards, Jan Am 27.07.2011, 10:15 Uhr, schrieb zahra zarei <[email protected]>:
hi every body I'm a new usr I'm going to study c60 molecule but Idon't know what nomber put in *DM.Mixing Weight *&*DM-NumberPulay* pleas help me tanks alot
