Re: [QE-users] R: R: QE 7.2 compilation with new Intel compilers

On 8/24/23 23:44, Kliavinek, Sergei wrote ./configure F90=ifx CC=mpiicx CFLAGS=-O3 FFLAGS=-O3 MPIF90=mpiifx --with-hdf5="/opt/hdf5" --enable-wannier90 I don't think the "-enable-wannier90" option exists checking version of mpiifx... unknown, assuming gfortran "configure" tries to figure o

Re: [QE-users] Random seed for MD calculations

Thank you for noticing again a problem. It will be fixed in next release: https://gitlab.com/QEF/q-e/-/merge_requests/2137 Paolo On 8/14/23 19:24, Han Hsu (徐翰) wrote: You don't often get email from han...@ncu.edu.tw. Learn why this is important