[CP2K-user] [CP2K:16361] Re: CPASSERT failed

mdsimula...@gmail.com mdsimulationgroup at gmail.com
Sat Dec 11 20:36:27 UTC 2021


There's not enough information here to help you.

On Friday, December 3, 2021 at 9:13:25 AM UTC-5 gibu... at gmail.com wrote:

> Hello, 
>
> I am very new to cp2k and I just tried to run single point calculation 
> with just 2 atoms of Si and I received this error. I don't have any idea 
> what this error means. Can anyone please help me:
>
>
>
> *******************************************************************************
>  *   ___                                                                  
>      *
>  *  /   \                                                                  
>     *
>  * [ABORT]                                                                
>      *
>  *  \___/                             CPASSERT failed                      
>     *
>  *    |                                                                    
>     *
>  *  O/|                                                                    
>     *
>  * /| |                                                                    
>     *
>  * / \                                                  
> cp_ddapc_methods.F:882 *
>
>  *******************************************************************************
>
>
>  ===== Routine Calling Stack =====
>
>             6 cp_ddapc_create
>             5 cp_ddapc_init
>             4 qs_env_update_s_mstruct
>             3 qs_energies_init_hamiltonians
>             2 qs_energies
>             1 CP2K
>
>

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