[Wien] Error information during installation of WIEN2k_16.1 on CentOs7
刘 洋
ly.esl at hotmail.com
Thu Jul 6 06:35:56 CEST 2017
Dear Everyone,
During installing WIEN2k_16.1, I saw a few following errors. However, at last, there is no error information had been shown. I am not sure it is OK or not.
During compiling---------------------
SRC_BerryPI ...
make: *** No rule to make target `clean'. Stop.
make: *** No targets specified and no makefile found. Stop.
SRC_clmcopy ...
make: Circular modules.o <- modules.o dependency dropped.
make: Circular reallocate.o <- modules.o dependency dropped.
make: Circular reallocate.o <- reallocate.o dependency dropped.
make[1]: Leaving directory '/home/liuyang/wien2k/SRC_dstart'
make: *** No rule to make target `complex'. Stop.
SRC_Globals …
make: *** No rule to make target 'clean'. Stop.
make: *** No targets specified and no makefile found.
make: *** No rule to make target 'clean'. Stop.
SRC_lapw0 ...
make[1]: pwxad4.o <- pwxad4.o dependency dropped.
make[1]: Leaving directory '/home/liuyang/wien2k/SRC_lapw0'
if [ -f /include/xc_funcs.h ]; then cp /include/xc_funcs.h .; fi
make: *** No rule to make target `complex'. Stop.
SRC_lapw1 …
W2kinit.o <- W2kinit.o dependency dropped.
SRC_lapw5 …
make: Circular modules.o <- modules.o dependency dropped.
make: Circular reallocate.o <- modules.o dependency dropped.
SRC_lapwso …
make[1]: Leaving directory '/home/liuyang/wien2k/SRC_lapwso
make: *** No rule to make target `complex'. Stop.
SRC_lcore …
make: *** No rule to make target `complex'. Stop.
SRC_lib …
make: *** No rule to make target `clean'. Stop.
make: *** No targets specified and no makefile found. Stop.
SRC_mini …
make: atomgrid.o <- atomgrid.o dependency dropped.
make: mxpmgrid.o <- atomgrid.o dependency dropped.
make: mxpmgrid.o <- mxpmgrid.o dependency dropped.
There are also some same problems in other sub-directories SRC_***
------------
Here is my compiler options
Linux (Intel ifort compiler (12.0 or later)+mkl (+intelmpi))
f90 compiler: ifort C compiler: icc
Current settings:
O Compiler options: -O1 -FR -mp1 -w -prec_div -pc80 -pad -ip -I/opt/intel/compilers_and_libraries_2017.4.196/linux/mkl/include
F FFTW options: -DFFTW3 -I/opt/local/fftw/include
X LIBX options:
E ELPA options:
L Linker Flags: -Wl,--start-group /opt/intel/compilers_and_libraries_2017.4.196/linux/mkl/lib/intel64/libmkl_intel_lp64.a /opt/intel/compilers_and_libraries_2017.4.196/linux/mkl/lib/intel64/libmkl_sequential.a /opt/intel/compilers_and_libraries_2017.4.196/linux/mkl/lib/intel64/libmkl_core.a -Wl,--end-group -lpthread -lm -ldl
P Preprocessor flags '-DParallel'
R R_LIB (LAPACK+BLAS): -lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -qopenmp -lpthread
FL FFTW_LIBS: -lfftw3_mpi -lfftw3 -L/opt/local/fftw/lib
XL LIBXC_LIBS:
EL ELPA_LIBS:
If you have A CLUSTER OF shared memory parallel computers answer next question with N
Shared Memory Architecture? (y/N):n
Do you know/need a command to bind your jobs to specific nodes ?
(like taskset -c). Enter N / your_specific_command: n
On most mpi-2 versions, it is better to start an mpijob on the original machine
and not via ssh on a remote system. If you are using mpi2 set MPI_REMOTE to 0
Set MPI_REMOTE to 0 / 1: 1
On linuxifc systems the remote shell normally is ssh,
which will be used as default.
Remote shell (default is ssh) = ssh
This is useful only for BIG cases (50 atoms and more / unit cell)
and your HARDWARE has at least 16 cores (or is a cluster with Infiniband)
You need to KNOW details about your installed MPI, ELPA, and FFTW )
(y/n) n
Waiting for the help. Thankyou.
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