Re: [Wien] unphysical growth of mag. moment with supercell size

2016-09-02 Thread Maciej Zwierzycki
On Fri, Sep 02, 2016 at 10:12:46PM +0800, Robert Laskowski wrote: > Hi, > > it could be that the program cuts your rkmax for larger systems. > grep :RKM to check what was used. Of course, silly me. Should've read the manual after all. ;( :WARN : WARNING: RKmax reduced due to NMATMAX :WARN :

Re: [Wien] unphysical growth of mag. moment with supercell size

2016-09-02 Thread Robert Laskowski
Hi, it could be that the program cuts your rkmax for larger systems. grep :RKM to check what was used. regards Robert On 02 September 2016 PM 3:51:34 Maciej Zwierzycki wrote: > Dear WIEN2k Users, > > I am trying to calculate the electronic structure (DOS, LDOS) of > magnetic impurity/add on a