plain serial compilation fails

Toon Verstraelen Toon.Ver... at UGent.be
Fri Feb 26 16:56:11 CET 2010


Hi,

This is probably trivial to fix. I get this error when compiling

toon at molmod49 ~/tmp/build/cp2k/makefiles:arch> make ARCH=Linux-x86-64-gfortran version=sdbg
make -C /home/toon/tmp/build/cp2k/makefiles/../obj/Linux-x86-64-gfortran/tools -f 
/home/toon/tmp/build/cp2k/makefiles/../makefiles/Makefile makedepf90
make[1]: Entering directory `/home/toon/tmp/build/cp2k/obj/Linux-x86-64-gfortran/tools'
make[1]: `makedepf90' is up to date.
make[1]: Leaving directory `/home/toon/tmp/build/cp2k/obj/Linux-x86-64-gfortran/tools'
make -C /home/toon/tmp/build/cp2k/makefiles/../src -f 
/home/toon/tmp/build/cp2k/makefiles/../makefiles/Makefile all.dep
make[1]: Entering directory `/home/toon/tmp/build/cp2k/src'
make[1]: `/home/toon/tmp/build/cp2k/makefiles/../obj/Linux-x86-64-gfortran/sopt/all.dep' 
is up to date.
make[1]: Leaving directory `/home/toon/tmp/build/cp2k/src'
make -C /home/toon/tmp/build/cp2k/makefiles/../src/lib -f 
/home/toon/tmp/build/cp2k/makefiles/../makefiles/Makefile lib.dep
make[1]: Entering directory `/home/toon/tmp/build/cp2k/src/lib'
make[1]: `/home/toon/tmp/build/cp2k/makefiles/../obj/Linux-x86-64-gfortran/sopt/lib.dep' 
is up to date.
make[1]: Leaving directory `/home/toon/tmp/build/cp2k/src/lib'
make -C /home/toon/tmp/build/cp2k/makefiles/../obj/Linux-x86-64-gfortran/sopt -f 
/home/toon/tmp/build/cp2k/makefiles/../makefiles/Makefile _progr
make[1]: Entering directory `/home/toon/tmp/build/cp2k/obj/Linux-x86-64-gfortran/sopt'
gfortran -c -O2 -ffast-math -funroll-loops -ftree-vectorize -march=native -ffree-form 
-ffree-line-length-none -D__GFORTRAN -D__FFTSG 
-D__COMPILE_ARCH="\"Linux-x86-64-gfortran\"" -D__COMPILE_DATE="\"Fri Feb 26 16:49:41 CET 
2010\"" -D__COMPILE_HOST="\"molmod49\"" 
-D__COMPILE_LASTCVS="\"9f59628cccd5fd657dde11c30a973648a22b3989\"" 
/home/toon/tmp/build/cp2k/makefiles/../src/qs_pdos.F
/home/toon/tmp/build/cp2k/makefiles/../src/qs_pdos.F:574.18:

          matrix_c=mo_virt, matrix_orthogonal_space=mo_coeff, &
                   1
Error: Keyword argument 'matrix_c' at (1) is not in the procedure
make[1]: *** [qs_pdos.o] Error 1
make[1]: Leaving directory `/home/toon/tmp/build/cp2k/obj/Linux-x86-64-gfortran/sopt'
make: *** [build] Error 2


The routine being called is ot_eigensolver. The arguments of ot_eigensolver changed a few 
days ago.

cheers,

Toon

-- 
Dr. ir. Toon Verstraelen
Center for Molecular Modeling
Ghent University
Technologiepark 903,
B9052 Zwijnaarde
Belgium
Tel: +32 9 264 65 56
E-mail: Toon.Ver... at UGent.be
http://molmod.UGent.be/
http://molmod.UGent.be/code/



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