Download and Install

Download

Download version 5.0.2 of Yambo.

wget https://github.com/yambo-code/yambo/archive/5.0.2.tar.gz

One should also download the dependent packages of Yambo by following commands

tar zxvf yambo-5.0.2.tar.gz && cd yambo-5.0.2/lib/archive && \
    make -f Makefile.loc

重要

The yambo-libraries-0.0.2.tar.gz package should also be download

Download version 0.0.2
Unpack and move the files to yambo code

tar zxvf yambo-libraries-0.0.2.tar.gz && \
    mv yambo-libraries-0.0.2/* yambo-5.0.2/lib/yambo

Compile

Before compile the yambo, one should compile the hdf5_1.12.0 code

Create configure file compile.sh

./configure FC="ifort" MPIFC="mpiifort" F77="ifort" MPIF77="mpiifort" CC="icc" MPICC="mpiicc" CPP="gcc -E -P" FPP="gfortran -E -P -cpp"   \
--enable-mpi \
--enable-open-mp \
--enable-dp \
--with-blas-libs="-lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -liomp5 -lpthread -lm" \
--with-lapack-libs="-lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -liomp5 -lpthread -lm" \
--with-fft-includedir=/opt/intel/compilers_and_libraries_2020.4.304/linux/mkl/include/fftw \
--with-fft-libs="-lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -liomp5 -lpthread -lm" \
--with-blacs-libs="-lmkl_scalapack_lp64 -lmkl_blacs_intelmpi_lp64 -lmkl_core -liomp5 -lpthread -lm" \
--with-scalapack-libs="-lmkl_scalapack_lp64 -lmkl_blacs_intelmpi_lp64 -lmkl_core -liomp5 -lpthread -lm" \
--with-hdf5-libs=/opt/software/HDF5_intelmpi/hdf5-1.12.0/hdf5/lib/libhdf5.a \
--with-hdf5-path=/opt/software/HDF5_intelmpi/hdf5-1.12.0/hdf5 \
--with-hdf5-libdir=/opt/software/HDF5_intelmpi/hdf5-1.12.0/hdf5/lib \
--with-hdf5-includedir=-I/opt/software/HDF5_intelmpi/hdf5-1.12.0/hdf5/include \

configure yambo

bash compile.sh

compile yambo

make core