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. $export FC=ifort . $export CC=gcc |
$export FC=ifort $export CC=gcc |
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. $export MATHLIB="-LMathLibDir -llapackname -lblasname" | $export MATHLIB="-LMathLibDir -llapackname -lblasname" |
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. $configure | $./configure |
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. --enable-debug=yes[no] Compile BDF in debug mode. . --enable-i8=yes[no] Compile BDF with 64 bit integrals. . --enable-openmp=yes[no] Compile BDF with OpenMP supporting. |
--enable-debug=yes[no] Compile BDF in debug mode. --enable-i8=yes[no] Compile BDF with 64 bit integrals. --enable-openmp=yes[no] Compile BDF with OpenMP supporting. |
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4. Make . $make |
4. Compile BDF package. {{{ $make }}} |
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. $export FC=ifort . $export CC=gcc . $export MATHILIB="-L/opt/intel -lmkl -lguide" . $./configure --enabale-i8=yes --enable-openmp=yes . $make |
{{{ $export FC=ifort $export CC=gcc $export MATHILIB="-L/opt/intel -lmkl -lguide" $./configure --enabale-i8=yes --enable-openmp=yes $make }}} |
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. $export FC=gfortran . $export CC=gcc $export MATHILIB="-L/Users/mike/mathlib -lblas -llapack" . $./configure --enabale-i8=yes --enable-openmp=yes . $make |
{{{ $export FC=gfortran $export CC=gcc $export MATHILIB="-L/Users/mike/mathlib -lblas -llapack" $./configure --enabale-i8=yes --enable-openmp=yes $make }}} |
Installation
Contents
System requirements
In principle, BDF support all Unix-like platforms. However, we strongly propose you to use BDF at Linux platform together Intel Fortran and C compiler because BDF package is developed and thoroughly tested on such platforms. System requirements of BDF is summarized as following lines:
- OS: Linux, Mac, FreeBSD, Unix
- Compiler: Fortran 90 compiler such as Intel, gfortran, g95
- Support softwares: Python, make
- Parallel environments: MPI
Configure and compile BDF package
Several steps are needed to install BDF package.
- Set fortran and C compiler.
- If you use bash shell, you can set fortran and c compiler:
$export FC=ifort $export CC=gcc
- Tips: If you ignored this step, the configure script will pick up the gfortran and gcc compiler as default.
- If you use bash shell, you can set fortran and c compiler:
- Set blas and lapack library.
- For flaxibality reason, we ask users to set blas and lapack libraries.
$export MATHLIB="-LMathLibDir -llapackname -lblasname"
- For flaxibality reason, we ask users to set blas and lapack libraries.
- Configure BDF package.
- After setting compiler and mathematic library. You can configure BDF by command configure in BDF root directory.
$./configure
Configure support several parameters.--enable-debug=yes[no] Compile BDF in debug mode. --enable-i8=yes[no] Compile BDF with 64 bit integrals. --enable-openmp=yes[no] Compile BDF with OpenMP supporting.
- After setting compiler and mathematic library. You can configure BDF by command configure in BDF root directory.
- Compile BDF package.
$make
- Some typical installation
- A 64bit machine with intel compiler and MKL library.
$export FC=ifort $export CC=gcc $export MATHILIB="-L/opt/intel -lmkl -lguide" $./configure --enabale-i8=yes --enable-openmp=yes $make
- A Mac laptop with gfortran, gcc and user compiled lapack and blas library
$export FC=gfortran $export CC=gcc $export MATHILIB="-L/Users/mike/mathlib -lblas -llapack" $./configure --enabale-i8=yes --enable-openmp=yes $make
- A 64bit machine with intel compiler and MKL library.