VASP 6.3.0 installation issue
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- Newbie
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VASP 6.3.0 installation issue
Hi,
I never installed VASP before, I followed instructions mentioned on wiki/index.php/Installing_VASP.6.X.X
Unfortunately, I am not able to create the makfile for my " Ubuntu 20.4 (AMD Ryzen 7) system.
Please help me to solve it.
Regards
I never installed VASP before, I followed instructions mentioned on wiki/index.php/Installing_VASP.6.X.X
Unfortunately, I am not able to create the makfile for my " Ubuntu 20.4 (AMD Ryzen 7) system.
Please help me to solve it.
Regards
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- Full Member
- Posts: 205
- Joined: Tue Jan 19, 2021 12:01 am
Re: VASP 6.3.0 installation issue
Hi,
Sure we can try to figure it out. Can you please post more information, like the makefile.include that you used and the stdout that shows how the installation fails?
Have a look at the Forum guidelines as a reference.
Best regards,
Marie-Therese
Sure we can try to figure it out. Can you please post more information, like the makefile.include that you used and the stdout that shows how the installation fails?
Have a look at the Forum guidelines as a reference.
Best regards,
Marie-Therese
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- Newbie
- Posts: 3
- Joined: Mon Feb 07, 2022 1:54 am
Re: VASP 6.3.0 installation issue
Hi, Marie-Therese
I have attached the makefile.include and stdout here as you suggested.
Thank you
Regards
I have attached the makefile.include and stdout here as you suggested.
Thank you
Regards
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- Global Moderator
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Re: VASP 6.3.0 installation issue
You are using an older makefile.include, that can lead to various complications.
In the VASP.6.3.0/arch folder there are newer templates for makefile.include using gfortran,
First please try one of those as template and provide the path for the following in the makefile.include:
OPENBLAS_ROOT
SCALAPACK_ROOT
FFTW_ROOT
In the VASP.6.3.0/arch folder there are newer templates for makefile.include using gfortran,
First please try one of those as template and provide the path for the following in the makefile.include:
OPENBLAS_ROOT
SCALAPACK_ROOT
FFTW_ROOT
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- Newbie
- Posts: 3
- Joined: Mon Feb 07, 2022 1:54 am
Re: VASP 6.3.0 installation issue
HI,
Thank you for reply and suggestion.
Now I have installed VASP on GPU.
It is running well.
Thanks once again.
Regards
Thank you for reply and suggestion.
Now I have installed VASP on GPU.
It is running well.
Thanks once again.
Regards
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- Global Moderator
- Posts: 460
- Joined: Mon Nov 04, 2019 12:44 pm
Re: VASP 6.3.0 installation issue
I'm glad we could help.