[CP2K-user] [CP2K:20265] Re: compilation aborted for pw_methods.F90 (code 1)

Luca luca.daumann at gmail.com
Fri May 31 10:11:13 UTC 2024


Dear Frederick

thank you for your reply.
I followed your advice, however, now there is a new issue :

cp2k-2024.1/src/motion/mc/mc_types.F(528): error #6795: The target must be 
of the same type and kind type parameters as the pointer.   [MC_INPUT_FILE]
      IF (PRESENT(mc_input_file)) mc_input_file => mc_par%mc_input_file
----------------------------------^
cp2k-2024.1/src/motion/mc/mc_types.F(750): error #6795: The target must be 
of the same type and kind type parameters as the pointer.   [MC_INPUT_FILE]
      IF (PRESENT(mc_input_file)) mc_par%mc_input_file => mc_input_file
-----------------------------------------^
/cp2k-2024.1/src/motion/mc/mc_types.F(142): error #6404: This name does not 
have a type, and must have an explicit type.   [MC_INPUT_FILE]
         mc_input_file => NULL(), mc_bias_file => NULL()
---------^
compilation aborted for mc_types.F90 (code 1)
make[3]: *** [mc_types.o] Error 1
make[3]: *** Waiting for unfinished jobs....


Could you please help ? Is this easily fixable like before? 

Best regards.
Luca 



  

Il giorno venerdì 31 maggio 2024 alle 10:20:17 UTC+2 Frederick Stein ha 
scritto:

> Dear Luca,
> Technically, this is a compiler bug (shortcuts arising from external 
> associate constructs are shared). What you can do locally is to add the 
> variable to the SHARED clause. Considering your compilers (considering the 
> error message, the Intel compilers are employed), you should employ a more 
> recent compiler if available.
> Best,
> Frederick
>
> Luca schrieb am Donnerstag, 30. Mai 2024 um 23:05:43 UTC+2:
>
>> Dear all
>>
>> I am trying to install cp2k-2024.1 using gcc10.3 and Intelmpi-2018 (or 
>> 2020) compilers, Unfortunately, I get the error:
>>
>>  cp2k-2024.1/src/pw/pw_methods.F(1678): error #6752: Since the OpenMP* 
>> DEFAULT(NONE) clause applies, the PRIVATE, SHARED, REDUCTION, FIRSTPRIVATE, 
>> or LASTPRIVATE attribute must be explicitly specified for every variable.   
>> [NGPTS]
>>             DO gpt = 1, ngpts
>> ------------------------^
>> cp2k-2024.1/src/pw/pw_methods.F(1687): error #6752: Since the OpenMP* 
>> DEFAULT(NONE) clause applies, the PRIVATE, SHARED, REDUCTION, FIRSTPRIVATE, 
>> or LASTPRIVATE attribute must be explicitly specified for every variable.   
>> [NGPTS]
>>             DO gpt = 1, ngpts
>> ------------------------^
>> compilation aborted for pw_methods.F90 (code 1)
>> make[3]: *** [pw_methods.o] Error 1
>> make[3]: *** Waiting for unfinished jobs....
>> make[2]: *** [all] Error 2
>> make[1]: *** [psmp] Error 2
>> make: *** [all] Error 2
>>
>> Could you please help to overcome this issue?
>>
>> Bets Regards.
>> Luca
>>
>>
>>

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