[Pw_forum] is there a way to convert a 'PRIMVEC' block (from xcrysden) into 'celldm' understood by QE

Hans Horn hannes at 2horns.com
Sat Sep 6 02:11:56 CEST 2014


Folks,

is there a way to convert a 'PRIMVEC' block (from xcrysden) into 
'celldm' as understood by QE ? I don't seem to be able to figure it out 
myself.

thx.,
H



More information about the users mailing list