[Pw_forum] scf error with HSE

[Paolo Giannozzi]

There is an out-of-bound error. I think I know why, but it is not
something easy to fix

Paolo

On Thu, Jun 15, 2017 at 5:19 PM, Hongsheng Liu <lhs.happy2007 at gmail.com> wrote:
> Dear Paolo,
>   Oh, got it. Thank you.
>
> Best regards,
> Hongsheng Liu
>
> 2017-06-15 17:10 GMT+02:00 Paolo Giannozzi <p.giannozzi at gmail.com>:
>>
>> 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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>
>
>
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-- 
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