[Wien] spin orbital error
박지훈
firstchannel8 at gmail.com
Sat Aug 8 04:37:16 CEST 2009
Dear you,
I want to calculate Magnetic Anistropy Energy.
So, I tried to calculate spin orbital. But everytime I get this error
: input conversion error, unit 5, file/home/wien/wiendata/aaaaa/aaaaa.inso
The file is the followings,
WFFIL
4 1 0 llmax,ipr,kpot
-10.0000 1.50000 emin,emax (output energy window)
0. 0. 1. direction of magnetization (lattice vectors)
NX number of atoms for which RLO is added
NX1 -4.97 0.005 atom number,e-lo,de (case.in1), repeat NX
times
0 0 0 0 0 number of atoms for which SO is switch off;
atoms
I do not understand what "unit 5", "NX", and "0 0 0 0 0" mean.
I want to know what the problem is...
I have tried for 6 hours, but I cannot figure out what the wrong is.
If you know why I get this error, please please send me an e-mail.
All my best,
Jihoon Park
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