(git:ccc2433)
distribution_methods.F File Reference

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Modules

module  distribution_methods
 Distribution methods for atoms, particles, or molecules.
 

Functions/Subroutines

subroutine, public distribution_methods::distribute_molecules_1d (atomic_kind_set, particle_set, local_particles, molecule_kind_set, molecule_set, local_molecules, force_env_section, prev_molecule_kind_set, prev_local_molecules)
 Distribute molecules and particles. More...
 
subroutine, public distribution_methods::distribute_molecules_2d (cell, atomic_kind_set, particle_set, qs_kind_set, molecule_kind_set, molecule_set, distribution_2d, blacs_env, force_env_section)
 Distributes the particle pairs creating a 2d distribution optimally suited for quickstep. More...