problem in my calculation
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problem in my calculation
Dear sir,
In my calculations: After relaxation,I am getting magnetic moment 0 for AlN, but after i did self consistent calculations I am getting magnetic moment 0.1345...why is this difference?. Could you please tell me why is it so? . Thank you.
Best Regards
SUNNY
In my calculations: After relaxation,I am getting magnetic moment 0 for AlN, but after i did self consistent calculations I am getting magnetic moment 0.1345...why is this difference?. Could you please tell me why is it so? . Thank you.
Best Regards
SUNNY
Last edited by sunny on Tue Sep 11, 2012 4:17 am, edited 1 time in total.
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- Global Moderator
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Re: problem in my calculation
Hi,
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