[QE-users] Error: Segmentation fault - invalid memory reference.
Paolo Giannozzi
p.giannozzi at gmail.com
Sun Mar 4 09:30:55 CET 2018
On Sat, Mar 3, 2018 at 7:01 PM, Paolo Giannozzi <p.giannozzi at gmail.com>
wrote:
figure out why it crashes. Most likely the code is accessing an unallocated
> variable. It might be sufficient to properly allocated PAW variables to
> avoid yhe crash.
>
sorry for the bad syntax: "It might be sufficient to properly ALLOCATE PAW
variables to avoid the crash". I don't know how LDA-1/2 works, but if it
works for USPP, it shouldn't be difficult to adapt it to PAW
P.
--
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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