[CP2K-user] [CP2K:21646] CPASSERT failed in input_enumeration_types.F

Thibaut Véry tvery42 at gmail.com
Wed Jul 9 13:50:04 UTC 2025


I recompiled with spglib and Sirius deactivated and it works now.

On Wednesday, 9 July 2025 at 14:44:44 UTC+2 Thibaut Véry wrote:

> Thank you for your feedback.
>
> The error comes from create_cp2k_root_section
> That's the only trace I have.
>
> I tried to remove parts of the input and even an empty input file create.
> The problem also appears with some input files in the regression tests.
>
> I suppose it is a compilation problem then.
>
>
> On Tuesday, 8 July 2025 at 15:04:12 UTC+2 Krack Matthias wrote:
>
>> Hi
>>
>>  
>>
>> If there is a traceback printed, then you can possibly get a hint from 
>> the calling routine. Otherwise, I have no better suggestion than to comment 
>> input blocks until the error disappears. That’s the approach I use in such 
>> cases to narrow down the error location.
>>
>>  
>>
>> HTH
>>
>>  
>>
>> Matthias
>>
>>  
>>
>> *From: *cp... at googlegroups.com <cp... at googlegroups.com> on behalf of 
>> Thibaut Véry <tve... at gmail.com>
>> *Date: *Tuesday, 8 July 2025 at 14:49
>> *To: *cp2k <cp... at googlegroups.com>
>> *Subject: *[CP2K:21622] CPASSERT failed in input_enumeration_types.F
>>
>> Hello,
>>
>>  
>>
>> I have an input file which creates a CPASSERT error  
>> in  input/input_enumeration_types.F:79
>>
>>  
>>
>> I use CP2K 2025.1 compiled with gcc/11.4.1 and intel-mpi/2021.9.
>>
>> I used cp2klint to check if the input file is correct and I got no error. 
>> Also I tried to convert it to json and I receive the same error
>>
>>  
>>
>> Is there a way to see which keyword is the problem?
>>
>>  
>>
>> It is not possible for me to display publicly the input file.
>>
>>  
>>
>> Best regards
>>
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>>
>

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