On Sep 20, 2012, at 21:15 , Peng Chen wrote: > In the Quantum Espresso, can I specify spin direction? E.g, in the > unit cell, spins of M1 and M2 are along c direction (spin of M1 is > opposite to that of M2), whereas spins of M3 and M4 are in b > direction. Can I simulate this magnetic structure in QE?
yes, it is called "noncolinear magnetization" P. --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
