[Pw_forum] el_ph_mat value in elphsum ?

Paolo Giannozzi giannozz at nest.sns.it
Mon Apr 21 16:06:30 CEST 2008


明文美 wrote:

> in elphsum, how el_ph_mat is calculated? although another subroutine 
> elphel can calculate el_ph_mat, the elphsum does not call elphel
> subroutine at all. 

it is called by other subroutines:
$ grep -i 'call elphel' espresso/PH/*f90
espresso/PH/elphon.f90:     CALL elphel (npert (irr), imode0, dvscfins)
espresso/PH/solve_linter.f90:        if (elph) call elphel (npe, imode0,
dvscfins)

Paolo
--
Paolo Giannozzi, Democritos and University of Udine, Italy


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