triqs_dftkit.vasp.driver.MPIHandler

class triqs_dftkit.vasp.driver.MPIHandler(mpi_exec: str = 'mpirun')

Handles MPI configuration and execution environment for parallel DFT calculations.

Attributes

mpi_exec

(str) The MPI executor command (e.g., “mpirun -np 16”).

Methods

get_env_vars()

Retrieve essential environment variables for subprocess execution.

is_master_node
report