[CP2K-user] [CP2K:16366] Re: Install on SGE Cluster w CentOS

Sebastian Muraru sebmuraru at gmail.com
Mon Dec 13 09:24:39 UTC 2021


Up if anyone can take a look / come up with an idea to try and make this 
work.

On Tuesday, 7 December 2021 at 13:54:54 UTC+2 Sebastian Muraru wrote:

> Hi, further on I am having some issues at the installation of COSMA.
> I have attached a screenshot of make.log . 
> Can someone provide any help on this?
>
> On Thursday, 2 December 2021 at 15:32:10 UTC+2 Sebastian Muraru wrote:
>
>> I am not sure whether what I have done is "correct", but one may follow 
>> the following steps if you get stuck the same way.
>> The "issue" takes place in the "download_pkg" function. You may find it 
>> in the tool_kit.sh in the scripts folder.
>>
>> It was not necessary probably, but I pasted it in the 
>> get_openblas_arch.sh script file. 
>> I've added the "--no-check-certificate" in the line:
>> local __wget_flags='--quiet --no-check-certificate'
>> It did download fine afterwards.
>>
>> On Thursday, 2 December 2021 at 14:18:36 UTC+2 Sebastian Muraru wrote:
>>
>>> Hi,
>>>
>>> I have previously successfully installed cp2k on a workstation (psmp). I 
>>> am now trying to do the same on an SGE cluster with similar machines.
>>>
>>> sim_job_output and sim_job_error attached. Also attached script.sh.png , 
>>> I am supposed to know my way around using install_cp2k_toolchain (at least 
>>> on a local workstation), however it seems some script 
>>> (get_openblas_arch.sh) does not download the package it is meant to. 
>>>
>>> Screenshot...14-12-38.png shows the point at which I get the error in 
>>> the get_openblas_arch.sh script.
>>>
>>> If anyone can help me out, I am grateful.
>>>
>>

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