OpenMolcas Intel-MPI 2018.3 with GA 5.7 Post-Compilation Verification
I've encountered 10 failed basic tests using "pymolcas verify --parallel 4" following successful MPI compilation with intel/18.0/64/18.0.3.222, intel-mpi/intel/2018.3/64 and intel-mkl/2018.3/3/64 modules OpenMolcas_make.out, which followed successful GA-5.7 compilation with these modules GA_make.out. All test failures are with respect to the "seward" and "scf" executables, and the output error contains a generic mpiexec "process terminated" message. What might be causing the seg fault using MPI? The issue does not appear to be with the compiled pymolcas executable--pymolcas verify passes all tests when run in serial.result
Edited by Jellby