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constant magnetism
Date: 2010/07/01 18:40
Name: Gabriel Greene   <gabriel.greene@tyndall.ie>


I am wondering if it is possible to keep the initial spin charges constant throughout an scf calculation, in order for the magnetic moment of a structure to not change during the course of a calculation?
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Re: constant magnetism ( No.1 )
Date: 2010/08/10 17:17
Name: JH Parq

No.
Edit the code yourself.
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Re: constant magnetism ( No.2 )
Date: 2010/12/07 01:00
Name: Zsolt Gercsi


Hi,

I would also be interested in such calculations.
Any hint which subroutine(s) should be edited?
Is there a flow diagram available for the call of routines?
I couldn't find it in the manual.
Best Regards,
Zsolt
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Re: constant magnetism ( No.3 )
Date: 2011/08/22 03:29
Name: mahyar  <mahyar_rezvani1322@yahoo.com>

Hi Dear friend
I hope you are well.
please send me constant magnetism for calculation by openmx program .
with warm regards
M.Rezvani
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