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vasp.4.6 compiling error
Posted: Fri Jul 06, 2007 9:30 am
by lanjh
./preprocess <fftmpi.F | /usr/bin/cpp -P -C -traditional >fftmpi.f90 -DMPI -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DRPROMU_DGEMV -DRACCMU_DGEMV
mpif90 -FR -lowercase -assume byterecl -O3 -xW -tpp7 -c fftmpi.f90
/export/mpi/mpich-intel/bin/mpif90: line 332: eval: -F: invalid option
eval: usage: eval [arg ...]
make: *** [fftmpi.o] 错误 2
Hi, I am compiling the parallel version of vasp. But the above message occurred now. Can anyone help me ? I am eager to your reply/ Thanks
vasp.4.6 compiling error
Posted: Sun Jul 08, 2007 7:35 pm
by admin
are you sure mpif90 is based on the intel compiler? -FR lowecase is an intel compiler option only, not valid for other compilers
vasp.4.6 compiling error
Posted: Mon Jul 09, 2007 1:11 am
by lanjh
thanks, Sir. This problem has been solved after I added the routine of MPIf90 in makefile.
But another problem occurred.
./preprocess <fftmpi.F | /usr/bin/cpp -P -C -traditional >fftmpi.f90 -DMPI -DHOST=\"LinuxIFC\" -DIFC -Dkind8 -DNGZhalf -DCACHE_SIZE=4000 -DPGF90 -Davoidalloc -DMPI_BLOCK=500 -DRPROMU_DGEMV -DRACCMU_DGEMV
/usr/local/mpich/bin/mpif90 -FR -lowercase -assume byterecl -O3 -xW -tpp7 -c fftmpi.f90
fortcom: Error: fftmpi.f90, line 78: This module file was generated for a different platform or by an incompatible compiler or compiler release. It cannot be read. [PREC]
USE prec
----------^
fortcom: Error: fftmpi.f90, line 80: This derived type name has not been declared. [GRID_3D]
TYPE (grid_3d) GRID
------------^
My compiler is intel 8.0. Why did these errors occur?
vasp.4.6 compiling error
Posted: Sun Jul 15, 2007 6:41 pm
by admin
it seems you have mixed up several compilations in the same directory.
vasp.4.6 compiling error
Posted: Wed Jul 18, 2007 8:20 am
by lanjh
Thanks Sir!
I have recompiled our vasp with your opinion, and solved the problem.
There is still another problem.
When testing our serial version,I found that unreasonable results occurred. After one cycle was calculated, the program claimed that: reached required accuracy, and exit. Can you tell me the reason for this problem? Thanks
vasp.4.6 compiling error
Posted: Fri Jul 20, 2007 3:24 am
by lanjh
Sir!
I have carried out the parallel version. But the following notes occurred. I want to know how to deal this problem.
/export/mpi/mpich-intel/bin/mpirun.ch_p4: line 77: cannot create temp file for here document: 设备上没有空间
I am looking forward to your reply.