Error starting first running


Just Got Here
After of the compilation I get the following error, because not found this library

mpirun -np 4 nwchem H2O.nw

nwchem: error while loading shared libraries: libmpi_f90.so.1: cannot open shared object file: No such file or directory
nwchem: error while loading shared libraries: libmpi_f90.so.1: cannot open shared object file: No such file or directory
nwchem: error while loading shared libraries: libmpi_f90.so.1: cannot open shared object file: No such file or directory
nwchem: error while loading shared libraries: libmpi_f90.so.1: cannot open shared object file: No such file or directory

Forum Vet
LD_LIBRARY_PATH
Yenner
You need to add the location of libmpi_f90.so.1 to the directories listed by the env. variable LD_LIBRARY_PATH
For example, assuming you are using bash, you might need the following command

export LD_LIBRARY_PATH=/opt/openmpi/lib

Just Got Here
Thank you very much dear Edoapra, the program is it running very well


Forum >> NWChem's corner >> Running NWChem