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gamma point version
Posted: Wed Oct 22, 2014 10:48 am
by davide.tiana
Dear,
I am trying to recompile vasp gamma with vtstt but I've got some issues. I was wondering if it is possible (so something weird in my makefile) or not
Kind Regards,
Davide
Re: gamma point version
Posted: Wed Oct 22, 2014 1:40 pm
by graeme
Hi Davide,
This is surprising. If you can build the regular version of vasp, then you can just add the vtst objects to the makefile.
If you do this and get an error, posting it here will help us solve the problem.
Graeme
Re: gamma point version
Posted: Wed Oct 22, 2014 5:00 pm
by davide.tiana
Thanks Graeme
here the error:
013_sp1.1.106/mkl/include -c xcgrad.f90
xcgrad.F(571): error #6633: The type of the actual argument differs from the type of the dummy argument. [DWORK]
CALL VDW_NONLOC(DCHARG,DWORK,DWORKG,DWORK4,EXC,GRIDC,LATT_CUR,stress)
-------------------------------^
compilation aborted for xcgrad.f90 (code 1)
make: *** [xcgrad.o] Error 1
Re: gamma point version
Posted: Wed Oct 22, 2014 5:56 pm
by graeme
This is unrelated to the vtstcode; you will get them same error message compiling vasp.
In my experience, you may have to change some argument types (e.g. dwork) to get things to build, or have a compiler flag that ignores the problem.