Help: How to install vaspsol for vasp.6.1.0

Questions regarding the compilation of VASP on various platforms: hardware, compilers and libraries, etc.


Moderators: Global Moderator, Moderator

Post Reply
Message
Author
cattlesheep
Newbie
Newbie
Posts: 4
Joined: Sat Jul 11, 2020 2:08 am

Help: How to install vaspsol for vasp.6.1.0

#1 Post by cattlesheep » Sat Jan 16, 2021 12:57 pm

I have tried to compile vaspsol with its guide for vasp.6.1.0,but failed
the error codes:
solvation.o: In function `pot_k_mp_vcorrection_':
solvation.f90:(.text+0xf41c): undefined reference to `m_sum_s_'
solvation.f90:(.text+0xf561): undefined reference to `m_sum_s_'
makefile:145: recipe for target 'vasp' failed
make[2]: *** [vasp] Error 1
make[2]: Leaving directory '/home/xxx/vasp/vasp.6.1.0/build/std'
cp: cannot stat 'vasp': No such file or directory
makefile:142: recipe for target 'all' failed
make[1]: *** [all] Error 1
make[1]: Leaving directory '/home/xxx/vasp/vasp.6.1.0/build/std'
makefile:6: recipe for target 'std' failed
make: *** [std] Error 2

How to deal with this problem.

henrique_miranda
Global Moderator
Global Moderator
Posts: 474
Joined: Mon Nov 04, 2019 12:41 pm
Contact:

Re: Help: How to install vaspsol for vasp.6.1.0

#2 Post by henrique_miranda » Sat Jan 16, 2021 6:57 pm

We (the VASP Team) don't provide support for vaspsol.
Some other users of the forum might be able to help you.
Alternatively, you might ask this question in the issues in the vaspsol github page:
https://github.com/henniggroup/VASPsol/issues

WencaiYi
Newbie
Newbie
Posts: 1
Joined: Sat Nov 16, 2019 11:30 pm

Re: Help: How to install vaspsol for vasp.6.1.0

#3 Post by WencaiYi » Sat Feb 13, 2021 12:22 am

well, you could modified src/mpi.F file to solve this question.
First, open src/mpi.F by "vim src/mpi.F" and found the "SUBROUTINE M_sum_s" at about line 1895, and then remove all the "!!" of this subfunction. Finally, compiling VASP and it will work fine.
GOOD LUCK!

cattlesheep
Newbie
Newbie
Posts: 4
Joined: Sat Jul 11, 2020 2:08 am

Re: Help: How to install vaspsol for vasp.6.1.0

#4 Post by cattlesheep » Tue Feb 23, 2021 4:39 pm

Thanks for the above answer, i have solved this problem. https://github.com/henniggroup/VASPsol/issues/43

Post Reply