[Wien] restricting magnetic moment of individual atom
محمد ارشد فرحان
arshadfarhan at gmail.com
Wed Mar 4 05:19:47 CET 2015
Dear Wien2k Developers and user,
hi,
I'm studying charge transfer mechanisms within LaCaMnO3 which has a mixture
of Mn+3 and Mn+4 oxidation state.
it is AFM with 4 Mn atoms in unit cell.
I want to fix magnetic moments of Mn atoms individually (i.e., different
magnetic moments for different Mn atoms)
any or all guidance will be appreciated.
Thanks,
Arshad
--
*M. Arshad Farhan*EMMG, Physics Division,
PINSTECH, Islamabad
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