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make vasp

Posted: Mon Jun 14, 2010 10:52 pm
by Sonny
Hello;
having difficulty making vasp using intel mkl, openmpi, ifort.

/vasp.4.lib/libdmy.a(diolib.o) : In function `nxtfru_':
diolib.f:(.text+0x57): undefined reference to `_gfortran_st_inquire'
undefined reference etc etc...

the libdmy.a & diolib.o are in vasp.4.lib
Can anyone explain or clarify please??

make vasp

Posted: Tue Jun 15, 2010 7:30 am
by alex
You need to compile both branches with the same compiler. You mention ifort, but gfortran is referenced. Curious!

alex

make vasp

Posted: Wed Jun 16, 2010 12:29 am
by Sonny
Oh silly me ;

Thanks I finally have vasp on my desktop now.

make vasp

Posted: Wed Jun 16, 2010 7:17 am
by alex
Happy VASPing!

make vasp

Posted: Fri Dec 17, 2010 3:23 am
by Gu Chenjie
Dear All, is there a detailed intruction that help me build the VASP 5.2?
I am using ifort, icc, openmpi and em64t CPU
thanks a lot.

make vasp

Posted: Mon Jan 31, 2011 12:12 pm
by admin
please use the makefile which is most appropriate for the compiler and the architecture you use. (most probably, this will be the makefile.linux_ifc_P4,
please replace ifc by ifort.

make vasp

Posted: Wed Mar 23, 2011 2:18 am
by vaspfonda
Dear all, I have problem with VASP 4.6 compilation. Please give me a hand.

I used pgf90, gcc, libgoto, liblapack-pgi, openmpi. My make file is based on "makefile.linux_pgi_opt" At the end of compilation, it show:

ld: cannot find -lrdmacm
make: *** [vasp] Error 1

Any idea? Thanks!

make vasp

Posted: Sat Oct 08, 2011 7:47 am
by zeralans
Hey guy,Glad to see you again, you've always brings us something different, so I always remember you. I want to be god make let me see you again. It will focus on your dynamic!!!!!!!!!!








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