[QE-developers] Little error in vexx_k?
Lucas
lucas.baguet at upmc.fr
Fri Dec 14 09:33:23 CET 2018
Dear QE developers,
I have a question concerning a routine in the "exx" library.
In "vexx_k", we want to apply the vexx potential to "m" vectors ("m"
being an input parameter). However, the arrays "psi" and "hpsi" are
declared with "max_ibands" as second dimension. "max_ibands" is not used
elsewhere in the routine, but "m" is. Note also that in "vexx_gamma" the
second dimension of "psi" and "hpsi" is "m".
Is there some reason for keeping "max_ibands" in that case?
Also, in both "vexx_k" and "vexx_gamma", a local array "fac" is declared
and allocated but does not seem to be used.
Sincerely,
Lucas Baguet
PS : I noticed that point while working on the ACFDT code with Maria
Hellgren and Lorenzo Paulatto at the IMPMC, Sorbonne Université, Paris.
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