[CP2K-user] [CP2K:14017] Re: Error in compilation with tool chain script

fa...@gmail.com fabia... at gmail.com
Sun Oct 11 16:27:27 UTC 2020

You should do exactly what it says here :"because it was created by a 
different version of GNU Fortran"
You have to compile the libraries of the toolchain with the same version of 
gfortran as you compile cp2k.

On Saturday, 10 October 2020 at 19:25:10 UTC+2 sum... at gmail.com wrote:

> Hii fabian, 
> Thanks for the help. Now I am able to install tool chain script. I use 
> "./install_cp2k_toolchain.sh" command for installation of  toolchain, and 
> it successfully installed. In the end local. sopt, local. sdbg, and local. 
> ssmp file created into the "toolchain/install/setup". Then I copy these 
> file into cp2k/arch directory. 
> But when I try to compile using " make -j ARCH=local VERSION=sopt", it is 
> showing error message. The error massage as following " Cannot read module 
> file 'libxxsmm. mod' opened at (1), because it was created by a different 
> version of GNU Fortran"... Compilation terminated.
> Please advise me what to do.
> Thanks
> On Fri, Oct 9, 2020 at 12:39 AM fa... at gmail.com <fa... at gmail.com> 
> wrote:
>> Hi,
>> If the script detects cuda on your system it attempts to install the 
>> libraries needed to compile cp2k with cuda support. To do so, you need to 
>> specify which GPU architecture you want to compile for. So you have two 
>> options
>>  - disable gpu support if you do not intend to use it (--enable-cuda=no)
>>  - specify the GPU architecture (--gpu-ver=XXX)
>> Use the --help switch for more information.
>> Fabian
>> On Friday, 9 October 2020 at 07:08:12 UTC+2 sum... at gmail.com wrote:
>>> Hello everyone,
>>> I have downloaded the CP2K 7.1 version in my local home directory. When 
>>> i am installing CP2k with tool chain script, i am getting a error message. 
>>> The error message is :
>>> "ERROR: (.install_cp2k_toolchain.sh) CUDA enabled, please choose GPU 
>>> architecture to compile for with --gpu-ver"
>>> Please help me regarding this.
>>> Thank you
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