[Wien] calculation of the effective U in APW methods (NiO)

[Sohaib Ehsan]

Dear WIEN2k users

I am using WIN2K_11.1, i want to calculate the effective U in APW methods
(NiO).
I am following this document given on  WIEN2k site
http://www.wien2k.at/reg_user/textbooks/Constraint_U.pdf

First i generate structure file, then run SUPERCELL and modified it by Ni
to Ni1 and copy it to NiO.struct filr
secondly, i run x SGROUP and copy it to .struct file
then run SCF cycle
after that i replace in1, in2, incdn & incup file with the files given in
the document.


This is the error occur during SCF cycle, after i replace in1,in2, incup &
incdn as given in the document above mention


LAPW0 END
 LAPW1 END
 LAPW1 END
 LAPW2 END
 LAPW2 END
 CORE  END
forrtl: severe (24): end-of-file during read, unit 5, file
/home/sohaib/Desktop/WIEN2k/NiO/NiO.inc
Image              PC        Routine            Line        Source
lcore              080B84ED  Unknown               Unknown  Unknown
lcore              080B7A65  Unknown               Unknown  Unknown
lcore              08088978  Unknown               Unknown  Unknown
lcore              0805C36A  Unknown               Unknown  Unknown
lcore              0805BC8B  Unknown               Unknown  Unknown
lcore              08071ED5  Unknown               Unknown  Unknown
lcore              08051B9B  insld_                    213  insld.f
lcore              0804DC8F  MAIN__                    135  hfsd.f
lcore              08049F51  Unknown               Unknown  Unknown
libc.so.6          0030ECE6  Unknown               Unknown  Unknown
lcore              08049E61  Unknown               Unknown  Unknown

>   stop error


THIS IN THE NiO.inc FILE after the error

 7 1.00
1,-1,2
2,-1,2
2, 1,2
2,-2,4
3,-1,2
3, 2,4
3,-3,2


Thanks