UT theoretical chemistry code forum

Hello,

I'm the systems administrator of a cluster on which some users work with VASP. One user asked me to install VTST with our existing VASP (v 5.4.4).

I was able to run make to generate vasp_ncl, vasp_std and vasp_gam. But make gpu or make gpu_ncl fails with the following error:

mpif90 -ffree-form -ffree-line-length-none -w -O2 -I/softs/fftw/include -c chain.f90
chain.f90:228:8:

USE neb
1
Fatal Error: Can't open module file ‘neb.mod’ for reading at (1): No such file or directory
compilation terminated.
make[2]: *** [chain.o] Error 1
make[2]: Leaving directory `/softs/vasp/ompi412/vasp.5.4.4.pl2/build/gpu'
cp: cannot stat ‘vasp’: No such file or directory
make[1]: *** [all] Error 1
make[1]: Leaving directory `/softs/vasp/ompi412/vasp.5.4.4.pl2/build/gpu'
make: *** [gpu] Error 2


Could someone help me please?
Thank you in advance.

If you look in /src/.objects, you will have to add the VTST code objects to the variable SOURCE_GPU in the same way that you did to SOURCE.

Thanks a lot.