Dear Prof. P. Blaha & WIEN2k Community,

  Can we implement the force minimization using "run_lapw -min -fc 0.5 -ec
0.0001 -cc 0.001"  in DFT+U calculation  ?



Thank you,
Shamim Sk
IIT Mandi, HP, India.
_______________________________________________
Wien mailing list
Wien@zeus.theochem.tuwien.ac.at
http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
SEARCH the MAILING-LIST at:  
http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html

Reply via email to