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organization_structure_of_the_grid [2010/01/20 14:22]
jelen
organization_structure_of_the_grid [2011/02/18 13:13] (current)
Line 1: Line 1:
-{{:​fireball:​grid:​structure_grid.png|}}+=====General Overview=====
  
 +{{:​fireball:​grid:​stucuture_grid_v1.png|}}
 +
 +=====SCF chart flow=====
 +{{:​fireball:​grid:​scf_loop_v1.png|}}
 +
 +=====List of files=====
 **List of files related/​modified to the Kohn-Sham module:** **List of files related/​modified to the Kohn-Sham module:**
 +(M) stands for a modified file 
  
  ​MODULES/​  ​MODULES/​
Line 68: Line 75:
    ​diag_k_KS.f90    ​diag_k_KS.f90
    ​kspace_KS.f90    ​kspace_KS.f90
 +
 + ​LOOPS/​
 +   ​scf_loops_ks.f90
        
  ​DASSEMBLERS/​  ​DASSEMBLERS/​
    ​getforces_KS.f90 (not yet)    ​getforces_KS.f90 (not yet)
    
organization_structure_of_the_grid.1263993767.txt.gz ยท Last modified: 2011/02/18 13:14 (external edit)