Re: GW calculations stops at dipoles
Posted: Thu Feb 03, 2022 1:02 pm
Thank you! This is just a test run so I will converge the results with respect to parameters such as response block size. QE is running on multiple nodes w/o a problem, but Yambo is not. I compiled both by using the same environment. Here are the modules I loaded.
module load gcc/10.3.0
module load lapack/3.8.0_gcc81
module load fftw3/3.3.5
module load intel/mpi/2021.3.0
module load intel/2021.3.0
module load intel/mkl/64/2020.0.166
module load scalapack/intelmpi/2.0.2
Burak
module load gcc/10.3.0
module load lapack/3.8.0_gcc81
module load fftw3/3.3.5
module load intel/mpi/2021.3.0
module load intel/2021.3.0
module load intel/mkl/64/2020.0.166
module load scalapack/intelmpi/2.0.2
Burak