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Installation procedure to CentOS7.6(Makefile.conf)

Appendix : Example of installation procedure to CentOS7.6 (Makefile.conf)

We will explain how to install this software and how to build external libraries required this software on CentOS7.6.

More information for building each libraries, refer to their installation manuals.

Preparation

At first, install the basic build toolchains and libraries as follows.

$ su
# yum group mark install "Development Tools"
# yum update
# yum install openmpi-devel cmake
# exit

Configure the MPI environment settings as follows.

module purge
module local mpi/openmpi-x86_64

If you write the above two lines in $HOME/.bash_profile, the settings will be reflected even after the next login.

Please check compilers and compiler wrapper for MPI works propery as follow.

$ which gcc g++ gfortran mpicc mpic++ mpifort
/usr/bin/gcc
/usr/bin/g++
/usr/bin/gfortran
/usr/lib64/openmpi/bin/mpicc
/usr/lib64/openmpi/bin/mpic++
/usr/lib64/openmpi/bin/mpifort

Installing libraries

Compile and install required libraries this software. Working directory is $HOME/work, destination directory for install is $HOME/local.

And add $HOME/local/bin to PATH environment variable as follows.

cd $HOME
mkdir work
mkdir -p local/bin local/lib local/include
export PATH=$HOME/local/bin:$PATH

Downloads

Downloads the following software and save it to working directory $HOME/work.

Software Link
REVOCAP_Refiner-1.1.04.tar.gz https://www.frontistr.com/download/
FrontISTR_V50.tar.gz https://www.frontistr.com/download/
OpenBLAS-0.2.20.tar.gz https://www.openblas.net/
metis-5.1.0.tar.gz https://gitlab.com/FrontISTR-Commons/METIS
https://gitlab.com/FrontISTR-Commons/GKlib
scalapack-2.0.2.tgz https://www.netlib.org/scalapack/
MUMPS_5.1.2.tar.gz https://mumps.enseeiht.fr/
trilinos-12.14.1-Source.tar.bz2 https://trilinos.org/download/

Compiling REVOCAP_Refiner

cd $HOME/work
tar xvf REVOCAP_Refiner-1.1.04.tar.gz
cd REVOCAP_Refiner-1.1.04
make
cp lib/x86_64-linux/libRcapRefiner.a $HOME/local/lib
cp Refiner/rcapRefiner.h $HOME/local/include

Compiling OpenBLAS

cd $HOME/work
tar xvf OpenBLAS-0.2.20.tar.gz
make BINARY=64 NO_SHARED=1 USE_OPENMP=1
make PREFIX=$HOME/local install

Compiling METIS

cd $HOME/work
tar xvf metis-5.1.0.tar.gz
cd metis-5.1.0
make config prefix=$HOME/local cc=gcc openmp=1
make
make install

Compiling ScaLAPACK

$ cd $HOME/work
$ tar xvf scalapack-2.0.2.tgz
$ cd scalapack-2.0.2
$ mkdir build
$ cmake -DCMAKE_INSTALL_PREFIX=$HOME/local \
        -DCMAKE_EXE_LINKER_FLAGS="-fopenmp" \
        -DBLAS_LIBRARIES=$HOME/local/lib/libopenblas.a \
        -DLAPACK_LIBRARIES=$HOME/local/lib/libopenblas.a \
        ..
$ make
$ make install

Compiling MUMPS

cd $HOME/work
tar xvf MUMPS_5.1.2.tar.gz
cd MUMPS_5.1.2
cp Make.inc/Makefile.inc.generic Makefile.inc

Change the following parts of copied Makefile.inc

$ vi Makefile.inc
$ cp Make.inc/Makefile.inc.generic Makefile.inc
$ vi Makefile.inc
LMETISDIR = $(HOME)/local
IMETIS    = -I$(LMETISDIR)/include
LMETIS    = -L$(LMETISDIR)/lib -lmetis

ORDERINGSF  = -Dmetis -Dpord

CC      = mpicc -fopenmp
FC      = mpifort -fopenmp
FL      = mpifort -fopenmp

LAPACK = -L$(HOME)/local/lib -lopenblas

SCALAP  = -L$(HOME)/local/lib -lscalapack

INCPAR = -I/usr/include/openmpi-x86_64

LIBPAR  = $(SCALAP) -L/usr/lib64/openmpi/lib -lmpi

LIBBLAS = -L$(HOME)/local/lib -lopenblas

OPTF    = -O -DBLR_MT -fopenmp
OPTC    = -O -I. -fopenmp
OPTL    = -O -fopenmp

Then execute make.

make
cp lib/*.a $HOME/local/lib
cp include/*.h $HOME/local/include

Compiling Trilinos ML

$ cd $HOME/work
$ tar xvf trilinos-12.14.1-Source.tar.gz
$ cd trilinos-12.14.1-Source
$ mkdir build
$ cmake -DCMAKE_INSTALL_PREFIX=$HOME/local \
        -DCMAKE_C_COMPILER=mpicc \
        -DCMAKE_CXX_COMPILER=mpic++ \
        -DCMAKE_Fortran_COMPILER=mpifort \
        -DTPL_ENABLE_MPI=ON \
        -DTPL_ENABLE_LAPACK=ON \
        -DTPL_ENABLE_SCALAPACK=ON \
        -DTPL_ENABLE_METIS=ON \
        -DTPL_ENABLE_MUMPS=ON \
        -DTPL_MUMPS_INCLUDE_DIRS=$HOME/local/include \
        -DTrilinos_ENABLE_ML=ON \
        -DTrilinos_ENABLE_Zoltan=ON \
        -DTrilinos_ENABLE_OpenMP=ON \
        -DTrilinos_ENABLE_Amesos=ON \
        -DTrilinos_ENABLE_ALL_OPTIONAL_PACKAGES=OFF \
        -DBLAS_LIBRARY_DIRS=$HOME/local/lib \
        -DLAPACK_LIBRARY_DIRS=$HOME/local/lib" \
        -DSCALAPACK_LIBRARY_DIRS=$HOME/local/lib" \
        -DBLAS_LIBRARY_NAMES="openblas" \
        -DLAPACK_LIBRARY_NAMES="openblas" \
        -DSCALAPACK_LIBRARY_NAMES="scalapack" \
        ..
$ make
$ make install

Compiling FrontISTR

Finishing compiling above libraries, compile FrontISTR.

cd $HOME/work
tar xvf FrontISTR_V50.tar.gz
cd FrontISTR

Editing Makefile.conf

Copy template as Makefile.conf.org to Makfile.conf. Then edit Makefile.conf as follows.

$ cp Makefile.conf.org Makefile.conf
$ vi Makefile.conf
##################################################
#                                                #
#     Setup Configulation File for FrontISTR     #
#                                                #
##################################################

# MPI
MPIDIR         = /usr/lib64/openmpi
MPIBINDIR      = $(MPIDIR)/bin
MPILIBDIR      = $(MPIDIR)/lib
MPIINCDIR      = /usr/include/openmpi-x86_64
MPILIBS        = -lmpi -lmpi_cxx -lmpi_mpifh

# for install option only
PREFIX         = $(HOME)/FrontISTR
BINDIR         = $(PREFIX)/bin
LIBDIR         = $(PREFIX)/lib
INCLUDEDIR     = $(PREFIX)/include

# Metis
METISDIR       = $(HOME)/local
METISLIBDIR    = $(METISDIR)/lib
METISINCDIR    = $(METISDIR)/include
HECMW_METIS_VER= 5

# Refiner
REFINERDIR     = $(HOME)/local
REFINERINCDIR  = $(REFINERDIR)/include
REFINERLIBDIR  = $(REFINERDIR)/lib

# Coupler
REVOCAPDIR     = $(HOME)/local
REVOCAPINCDIR  = $(REVOCAPDIR)/include
REVOCAPLIBDIR  = $(REVOCAPDIR)/lib

# MUMPS
MUMPSDIR       = $(HOME)/local
MUMPSINCDIR    = $(MUMPSDIR)/include
MUMPSLIBDIR    = $(MUMPSDIR)/lib
MUMPSLIBS      = -ldmumps -lmumps_common -lpord -L$HOME/local/lib -lscalapack

# MKL PARDISO
MKLDIR     = $(HOME)/
MKLINCDIR  = $(MKLDIR)/include
MKLLIBDIR  = $(MKLDIR)/lib

# ML
MLDIR          = $(HOME)/local
MLINCDIR       = $(MLDIR)/include
MLLIBDIR       = $(MLDIR)/lib
MLLIBS         = -lml -lamesos -ltrilinosss -lzoltan -lepetra -lteuchosremainder -lteuchosnumerics -lteuchoscomm -lteuchosparameterlist -lteuchoscore -ldmumps -lmumps_common -lpord -lmetis
# C compiler settings
CC             = mpicc -fopenmp
CFLAGS         =
LDFLAGS        = -lstdc++ -lm
OPTFLAGS       = -O3

# C++ compiler settings
CPP            = mpic++ -fopenmp
CPPFLAGS       =
CPPLDFLAGS     =
CPPOPTFLAGS    = -O3

# Fortran compiler settings
F90            = mpif90 -fopenmp
F90FLAGS       =
F90LDFLAGS     = -lstdc++ -L$(HOME)/local/lib -lopenblas
F90OPTFLAGS    = -O2
F90FPP         = -cpp
F90LINKER      = mpif90 -fopenmp

MAKE           = make
AR             = ar ruv
MV             = mv -f
CP             = cp -f
RM             = rm -f
MKDIR          = mkdir -p

Executing setup.sh

Finished to edit Makefile.conf, then execute setup.sh.

$ ./setup.sh -p --with-tools --with-refiner \
             --with-metis --with-mumps --with-lapack --with-ml

Executing make

Execute make command.

make

Executing make install

make install

FrontISTR will be installed to $(HOME)/FrontISTR/bin.

Testing FrontISTR

Run sample case in the tutorial directory and check running of FrontISTR.

$ cd $HOME/work/FrontISTR/tutorial
$ cd 01_elastic_hinge
$ $HOME/FrontISTR/bin/fistr1
 Step control not defined! Using default step=1
 fstr_setup: OK
 Start visualize PSF 1 at timestep 0

 loading step=    1
 sub_step= 1,   current_time=  0.0000E+00, time_inc=  0.1000E+01
 loading_factor=    0.0000000   1.0000000
### 3x3 BLOCK CG, SSOR, 1
      1    1.903375E+00
      2    1.974378E+00
      3    2.534627E+00
      4    3.004045E+00
      5    3.202633E+00
      6    3.203864E+00
...
...

When finished analysis, displayed message as follows.

...
...
   2966    1.143085E-08
   2967    1.078272E-08
   2968    1.004759E-08
   2969    9.372882E-09
### Relative residual = 9.39169E-09

### summary of linear solver
      2969 iterations      9.391687E-09
    set-up time      :     4.108060E-01
    solver time      :     6.506822E+01
    solver/comm time :     4.342469E-01
    solver/matvec    :     1.923199E+01
    solver/precond   :     2.688405E+01
    solver/1 iter    :     2.191587E-02
    work ratio (%)   :     9.933263E+01

 Start visualize PSF 1 at timestep 1
### FSTR_SOLVE_NLGEOM FINISHED!

 ====================================
    TOTAL TIME (sec) :     74.93
           pre (sec) :      1.86
         solve (sec) :     73.07
 ====================================
 FrontISTR Completed !!