[Wien] EFG dependence on magnetic field

Aftab Khan aftabfsa at yahoo.com
Wed Sep 9 14:38:52 CEST 2015


kindly tell how i would get master in wien 2kif you have any simple way to tell 


     On Monday, September 7, 2015 1:27 PM, Muhammad Sajjad <sajjadpu at gmail.com> wrote:
   

 Thank you veru much Dear Gavin
On Mon, Sep 7, 2015 at 11:25 AM, Gavin Abo <gsabo at crimson.ua.edu> wrote:

  Yes
 
 On 9/7/2015 1:55 AM, Muhammad Sajjad wrote:
  
 Dear Gavin Bundle of thanks for such a helping reply. Are the case.inorb and case.indm files are ok now for B-ext applied at 32 degree angle with x-axis? 
   
  ================== case.inorb =====================
  3  2  0                     nmod, natorb, ipr
PRATT  1.0                    BROYD/PRATT, mixing
  1 1 2                       iatom nlorb, lorb   2 1 2                       iatom nlorb, lorb 8. Bext 1. 0.62487 0. direction================================================================ case.indm =====================-9. Emin cutoff energy 2 number of atoms for which density matrix is calculated 1 1 2 index of 1st atom, number of L's, L1  2  1  2      dtto for 2nd atom, repeat NATOM times 0 0 r-index, (l,s)index==============================================  
   
 
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-- 
Kind RegardsMuhammad Sajjad Post Doctoral FellowKAUST, KSA.
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