[Pw_forum] fixed spin moment calculations

Adeagbo Waheed Adeniyi adeagbo at thp.Uni-Duisburg.de
Wed Apr 4 22:15:37 CEST 2007


Dear PWSCF users,
I will like to do fixed spin moment calculations, .i.e. I want the 
magnetization (such as 5.0 uB) to be kept fixed in my calculations. 
Can anyone kindly suggest me the parameter(s) or how to specify the 
options in the manual?

Regards
Waheed
 



More information about the users mailing list