[CP2K:3676] I meet a trouble in compiling OpenMP version of cp2k.

Alin Marin Elena alinm... at gmail.com
Wed Dec 14 17:51:29 CET 2011


Can you tell us the version of your compiler?
ifort -v

Alin

On 14 December 2011 15:16, 朱红 <zhuho... at gmail.com> wrote:
> dear all.
> When I want to compile a OpenMP version of cp2k, I got a error for source
> code.
>
> /export/home/zhuh/cp2k/makefiles/../src/dbcsr_lib/dbcsr_work_operations.F(1554):
> error #7926: Form of assignment statement following !$OMP ATOMIC directive
> is improper.   [WM]
>     new_nze = new_nze + wm%datasize
> ------------------------^
>
> Who can give me some suggestion?
> Here is my  Linux-x86-64-intel.ssmp file.
>
> INTEL_INC=/usr/local/include
> INTEL_LIB=/opt/acml4.4.0/ifort64/lib
>
> CC       = cc
> CPP      =
> FC       = ifort -FR -openmp -O0
> LD       = ifort -FR -openmp -O0
> AR       = ar -r
> DFLAGS   = -D__INTEL -D__FFTSG -D__FFTW3 -D__FFTACML
> CPPFLAGS = -C -traditional $(DFLAGS) -I$(INTEL_INC)
> FCFLAGS  = $(DFLAGS) -I$(INTEL_INC)
> LDFLAGS  = $(FCFLAGS)
> LIBS     = $(INTEL_LIB)/libacml.a\
>            $(INTEL_LIB)/libacml_mv.a \
>            -lfftw3
>
> OBJECTS_ARCHITECTURE = machine_intel.o
>
> Best wishes for all from hefei.
>
>
> --
>   Zhu Hong
>   Department of Polymer Science and Engineering
>   University of Science and Technology of China
>   Hefei, Anhui 230026, P.R.China
>
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