Problem compiling instanton.F

Vasp transition state theory tools

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GingerF
Posts: 2
Joined: Fri Jun 04, 2021 3:12 pm

Problem compiling instanton.F

Post by GingerF »

Dear professor,
I am a beginner of VASP. I tried to compile VTST-182 with VASP 5.4.4. However, I run into a problem during the compilation of instanton.F file. I got the error below:

mpiifort -free -names lowercase -assume byterecl -w -O2 -xHOST -I/opt/intel/compilers_and_libraries_2019.1.144/linux/mkl/include/fftw -c instanton.f90
instanton.F(57): error #6580: Name in only-list does not exist or is not accessible. [RANE]
USE random_seeded, ONLY: RANE
-------------------------------^
instanton.F(208): error #6580: Name in only-list does not exist or is not accessible. [RANE]
USE random_seeded, ONLY: RANE
-------------------------------^
instanton.F(433): error #6404: This name does not have a type, and must have an explicit type. [RANE]
w(i,j,im)=rane()-0.5_q
----------------------------^
compilation aborted for instanton.f90 (code 1)
make[2]: *** [instanton.o] Error 1
make[2]: Leaving directory `/root/chem/vasp.5.4.4/build/std'
cp: cannot stat ‘vasp’: No such file or directory
make[1]: *** [all] Error 1
make[1]: Leaving directory `/root/chem/vasp.5.4.4/build/std'
make: *** [std] Error 2

FYI, I am using centOS 8 stream with Intel_Parallel_Studio_XE.

Could you please help me with this problem?

Thank you!

GingerF
graeme
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Re: Problem compiling instanton.F

Post by graeme »

For version of vasp < 6, I have the vtstcode in subdirectories. In your case with vasp 5.4.4, use the files in the vtstcode5 subdirectory.
GingerF
Posts: 2
Joined: Fri Jun 04, 2021 3:12 pm

Re: Problem compiling instanton.F

Post by GingerF »

Hi graeme,

Thank you very much for your prompt response!

I successfully compiled the VTST using the files in the vtstcode5 subdirectory and it worked nicely.

Thanks again!

Best regards,

GingerF
graeme
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Re: Problem compiling instanton.F

Post by graeme »

fantastic!
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