[Pw_forum] fhi2upf.f90

[ramesh kumar]

Dear all

i want to convert the pseudopotential from abinit form to pwscf form. i used the executable fhi2upf.x. it asked (wavefunction 1,2,3 and 4) label and occupancy 

print '("Wavefunction # ",i1,": label, occupancy > ",$)', i
     read (5,*) els(i), oc(i)
     nns (i)  = 0
     lchi(i)  = i-1
     rcut(i)  = 0.0d0
     rcutus(i)= 0.0d0
     epseu(i) = 0.0d0

i compared with the available UPF format and it should be nl and occupancy but how to feed it???????

with regards
K. Ramesh Kumar
Research scholar 
Department of physics
IIT Madras
Chennai-600036
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