[Pw_forum] scf error with HSE

Paolo Giannozzi p.giannozzi at gmail.com
Thu Jun 15 17:10:53 CEST 2017


On Thu, Jun 15, 2017 at 5:00 PM, Hongsheng Liu <lhs.happy2007 at gmail.com> wrote:

> I don't think any significant information hidden in the ......

the following section is called "traceback" and tells you where
exactly the code crashed. Sometimes it allows to quickly fix a problem
(but sometimes it doesn't)

> pw.x               00000000005DF534  us_exx_mp_addusxx         246  us_exx.f90
> [...]

> pw.x               00000000005E24A4  us_exx_mp_addusxx         244  us_exx.f90
> pw.x               0000000000485B63  exx_mp_vexx_k_           1913  exx.f90
> pw.x               00000000004D4712  exx_mp_vexx_             1252  exx.f90
> pw.x               00000000004D4E2D  exx_mp_aceinit_k_        5431  exx.f90
> pw.x               00000000004D5CBD  exx_mp_aceinit_          5236  exx.f90
> pw.x               00000000004E1542  exx_mp_exxinit_          1121  exx.f90
> pw.x               000000000040A69C  electrons_                175  electrons.f90
> pw.x               000000000057FD15  run_pwscf_                 99  run_pwscf.f90
> pw.x               0000000000408770  MAIN__                     56  pwscf.f90

Paolo
-- 
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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