[Wien] cucle 1 LAPW2 not finished
Zahia Aboub
aboubz at yahoo.com
Wed Oct 15 13:55:55 CEST 2014
I use calcul simple for propreté structural at Ni doped SrTiO3,
I used the structure to attached and in initialisation utilise separation energie=-6, Rmt*Kmax=7 and K
piont =1, but at scf (cucle 1 LAPW2 not finished )please halps mi
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