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Spatial domain decomposition (for parallelization over MPI)
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Description

Manages the decomposition of the simulation volume over MPI ranks to try to distribute work evenly with minimal communication overheads.

Todo:
Get domdec stuff out of mdtypes/commrec.h
Author
Berk Hess hess@.nosp@m.kth..nosp@m.se

Files

file  domdec.h
 This file declares functions for mdrun to call to manage the details of its domain decomposition.
 
file  domdec_network.h
 This file declares functions for (mostly) the domdec module to use MPI functionality.
 
file  domdec_struct.h
 Declares structures related to domain decomposition.
 
file  ga2la.h
 Defines structures and functions for mapping from global to local atom indices. The functions are performance critical and should be inlined.