Dear Experts,
I’m sorry to trouble you. I tried to make metadynamics calculation with plumed package, but it end up with the error message:
application called MPI_Abort(comm=0x84000004, 1) - process 0
application called MPI_Abort(comm=0x84000002, 1) - process 1
It seems maybe I make mistake to compile PLUMED with MPI. My operating system is Ubuntu 16.04 and my lammps version is “lammps-16Mar18”, installed with mpich-3.2.1 and fftw-3.3.8. I think I have already complied LAMMPS with MPI, and LAMMPS calculation run if I do not call PLUMED. When I install PLUMED-2.3.6, I used the following command:
./configure CXX=mpicxx CC=mpicc
sudo make -j 8
sudo make install
When the “configure” command is over, there is a configure message “PLUMED will be compiled using MPI”.
Would you mind point out my msitake?
Thank you very much, and I look forward to hearing from you.