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chuckv |
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!! MPI support for long range forces using force decomposition |
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!! on a square grid of processors. |
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!! Corresponds to mpiSimunation.cpp for C++ |
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!! mpi_module also contains a private interface for mpi f90 routines. |
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!! |
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!! @author Charles F. Vardeman II |
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!! @author Matthew Meineke |
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chuckv |
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!! @version $Id: mpiSimulation_module.F90,v 1.4 2003-01-30 15:20:21 chuckv Exp $, $Date: 2003-01-30 15:20:21 $, $Name: not supported by cvs2svn $, $Revision: 1.4 $ |
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chuckv |
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module mpiSimulation |
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chuckv |
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#ifdef IS_MPI |
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chuckv |
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use mpi |
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implicit none |
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PRIVATE |
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!! PUBLIC Subroutines contained in this module |
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!! gather and scatter are a generic interface |
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!! to gather and scatter routines |
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public :: gather, scatter |
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public :: setupSimParallel |
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public :: replanSimParallel |
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chuckv |
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public :: getNcol |
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public :: getNrow |
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chuckv |
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public :: isMPISimSet |
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chuckv |
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chuckv |
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!! PUBLIC Subroutines contained in MPI module |
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public :: mpi_bcast |
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public :: mpi_allreduce |
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public :: mpi_reduce |
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public :: mpi_send |
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public :: mpi_recv |
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public :: mpi_get_processor_name |
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public :: mpi_finalize |
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!! PUBLIC mpi variables |
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public :: mpi_comm_world |
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public :: mpi_character |
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public :: mpi_integer |
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public :: mpi_double_precision |
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public :: mpi_sum |
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public :: mpi_max |
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public :: mpi_status_size |
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public :: mpi_any_source |
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!! Safety logical to prevent access to ComponetPlan until |
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!! set by C++. |
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logical :: ComponentPlanSet = .false. |
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!! generic mpi error declaration. |
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integer,public :: mpi_err |
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chuckv |
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chuckv |
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!! Include mpiComponentPlan type. mpiComponentPlan is a |
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!! dual header file for both c and fortran. |
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#define __FORTRAN90 |
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#include "mpiComponentPlan.h" |
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chuckv |
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!! Tags used during force loop for parallel simulation |
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integer, allocatable, dimension(:) :: tagLocal |
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integer, public, allocatable, dimension(:) :: tagRow |
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integer ,public, allocatable, dimension(:) :: tagColumn |
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!! Logical set true if mpiSimulation has been initialized |
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chuckv |
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logical :: isSimSet = .false. |
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chuckv |
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chuckv |
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!! gs_plan contains plans for gather and scatter routines |
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type, public :: gs_plan |
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private |
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type (mpiComponentPlan), pointer :: gsComponentPlan => NULL() |
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integer :: gsPlanSize !! size of this plan (nDim*nComponents) |
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integer :: globalPlanSize !! size of all components in plan |
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integer, dimension(:), pointer :: displs !! Displacements array for mpi indexed from 0. |
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integer, dimension(:), pointer :: counts !! Counts array for mpi indexed from 0. |
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integer :: myPlanComm !! My communicator for this plan |
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integer :: myPlanRank !! My rank in this plan |
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integer :: planNprocs !! Number of processors in this plan |
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end type gs_plan |
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! plans for different decompositions |
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type (gs_plan), public :: plan_row |
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type (gs_plan), public :: plan_row3d |
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type (gs_plan), public :: plan_col |
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type (gs_plan), public :: plan_col3d |
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type (mpiComponentPlan), pointer :: simComponentPlan |
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! interface for gather scatter routines |
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!! Generic interface for gather. |
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!! Gathers an local array into row or column array |
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!! Interface provided for integer, double and double |
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!! rank 2 arrays. |
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interface gather |
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module procedure gather_integer |
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module procedure gather_double |
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module procedure gather_double_2d |
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end interface |
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!! Generic interface for scatter. |
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!! Scatters a row or column array, adding componets |
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!! and reducing them to a local nComponent array. |
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!! Interface provided for double and double rank=2 arrays. |
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interface scatter |
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module procedure scatter_double |
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module procedure scatter_double_2d |
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end interface |
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chuckv |
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chuckv |
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contains |
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!! Sets up mpiComponentPlan with structure passed from C++. |
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chuckv |
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subroutine setupSimParallel(thisComponentPlan,ntags,tags,status) |
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chuckv |
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! Passed Arguments |
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! integer, intent(inout) :: nDim !! Number of dimensions |
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!! mpiComponentPlan struct from C |
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chuckv |
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type (mpiComponentPlan), intent(inout) :: thisComponentPlan |
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!! Number of tags passed, nlocal |
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integer, intent(in) :: ntags |
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!! Result status, 0 = normal, -1 = error |
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chuckv |
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integer, intent(out) :: status |
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chuckv |
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integer :: localStatus |
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!! Global reference tag for local particles |
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integer, dimension(ntags),intent(inout) :: tags |
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chuckv |
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status = 0 |
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if (componentPlanSet) then |
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return |
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endif |
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componentPlanSet = .true. |
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call make_Force_Grid(thisComponentPlan,localStatus) |
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if (localStatus /= 0) then |
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status = -1 |
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return |
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endif |
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call updateGridComponents(thisComponentPlan,localStatus) |
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if (localStatus /= 0) then |
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status = -1 |
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return |
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endif |
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!! initialize gather and scatter plans used in this simulation |
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call plan_gather_scatter(1,thisComponentPlan%nComponentsRow,& |
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thisComponentPlan,row_comm,plan_row) |
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call plan_gather_scatter(nDim,thisComponentPlan%nComponentsRow,& |
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thisComponentPlan,row_comm,plan_row3d) |
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call plan_gather_scatter(1,thisComponentPlan%nComponentsColumn,& |
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thisComponentPlan,col_comm,plan_col) |
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call plan_gather_scatter(nDim,thisComponentPlan%nComponentsColumn,& |
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thisComponentPlan,col_comm,plan_col3d) |
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chuckv |
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! Initialize tags |
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call setTags(tags,localStatus) |
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if (localStatus /= 0) then |
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status = -1 |
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return |
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endif |
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isSimSet = .true. |
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chuckv |
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end subroutine setupSimParallel |
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subroutine replanSimParallel(thisComponentPlan,status) |
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! Passed Arguments |
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!! mpiComponentPlan struct from C |
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type (mpiComponentPlan), intent(inout) :: thisComponentPlan |
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integer, intent(out) :: status |
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chuckv |
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integer, intent(out) :: localStatus |
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chuckv |
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status = 0 |
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call updateGridComponents(thisComponentPlan,localStatus) |
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if (localStatus /= 0) then |
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status = -1 |
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return |
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endif |
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!! Unplan Gather Scatter plans |
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call unplan_gather_scatter(plan_row) |
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call unplan_gather_scatter(plan_row3d) |
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call unplan_gather_scatter(plan_col) |
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call unplan_gather_scatter(plan_col3d) |
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!! initialize gather and scatter plans used in this simulation |
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call plan_gather_scatter(1,thisComponentPlan%nComponentsRow,& |
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thisComponentPlan,row_comm,plan_row) |
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call plan_gather_scatter(nDim,thisComponentPlan%nComponentsRow,& |
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thisComponentPlan,row_comm,plan_row3d) |
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call plan_gather_scatter(1,thisComponentPlan%nComponentsColumn,& |
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thisComponentPlan,col_comm,plan_col) |
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call plan_gather_scatter(nDim,thisComponentPlan%nComponentsColumn,& |
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thisComponentPlan,col_comm,plan_col3d) |
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end subroutine replanSimParallel |
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!! Updates number of row and column components for long range forces. |
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subroutine updateGridComponents(thisComponentPlan,status) |
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type (mpiComponentPlan) :: thisComponentPlan !! mpiComponentPlan |
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!! Status return |
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!! - 0 Success |
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!! - -1 Failure |
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integer, intent(out) :: status |
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integer :: nComponentsLocal |
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integer :: nComponentsRow = 0 |
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integer :: nComponensColumn = 0 |
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integer :: mpiErrors |
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status = 0 |
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if (.not. componentPlanSet) return |
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if (thisComponentPlan%myNlocal == 0 ) then |
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status = -1 |
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return |
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endif |
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nComponentsLocal = thisComponentPlan%myNlocal |
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call mpi_allreduce(nComponentsLocal,nComponentsRow,1,mpi_integer,& |
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mpi_sum,thisComponentPlan%rowComm,mpiError) |
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if (mpiErrors /= 0) then |
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status = -1 |
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return |
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endif |
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call mpi_allreduce(nComponentsLocal,nComponentsColumn,1,mpi_integer, & |
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mpi_sum,thisComponentPlan%columnComm,mpiError) |
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if (mpiErrors /= 0) then |
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status = -1 |
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return |
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endif |
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thisComponentPlan%nComponentsRow = nComponentsRow |
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thisComponentPlan%nComponentsColumn = nComponentsColumn |
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end subroutine updateGridComponents |
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!! Creates a square force decomposition of processors into row and column |
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!! communicators. |
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subroutine make_Force_Grid(thisComponentPlan,status) |
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type (mpiComponentPlan) :: thisComponentPlan |
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integer, intent(out) :: status !! status returns -1 if error |
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integer :: nColumnsMax !! Maximum number of columns |
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integer :: nWorldProcessors !! Total number of processors in World comm. |
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integer :: rowIndex !! Row for this processor. |
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integer :: columnIndex !! Column for this processor. |
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integer :: nRows !! Total number of rows. |
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integer :: nColumns !! Total number of columns. |
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integer :: mpiErrors !! MPI errors. |
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integer :: rowCommunicator !! MPI row communicator. |
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integer :: columnCommunicator |
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integer :: myWorldRank |
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integer :: i |
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if (.not. ComponentPlanSet) return |
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status = 0 |
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!! We make a dangerous assumption here that if numberProcessors is |
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!! zero, then we need to get the information from MPI. |
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if (thisComponentPlan%numberProcessors == 0 ) then |
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call mpi_comm_size( MPI_COMM_WORLD, nWorldProcessors,mpiErrors) |
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if ( mpiErrors /= 0 ) then |
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status = -1 |
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return |
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endif |
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call mpi_comm_rank( MPI_COMM_WORLD,myWorldRank,mpiErrors) |
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if ( mpiErrors /= 0 ) then |
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status = -1 |
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return |
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endif |
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else |
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nWorldProcessors = thisComponentPlan%numberProcessors |
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chuckv |
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myWorldRank = thisComponentPlan%myNode |
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chuckv |
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endif |
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nColumnsMax = nint(sqrt(real(nWorldProcessors,kind=dp))) |
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do i = 1, nColumnsMax |
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if (mod(nWorldProcessors,i) == 0) nColumns = i |
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end do |
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nRows = nWorldProcessors/nColumns |
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rowIndex = myWorldRank/nColumns |
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call mpi_comm_split(mpi_comm_world,rowIndex,0,rowCommunicator,mpiError) |
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if ( mpiErrors /= 0 ) then |
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status = -1 |
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return |
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endif |
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columnIndex = mod(myWorldRank,nColumns) |
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call mpi_comm_split(mpi_comm_world,columnIndex,0,columnCommunicator,mpiError) |
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if ( mpiErrors /= 0 ) then |
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status = -1 |
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return |
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endif |
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! Set appropriate components of thisComponentPlan |
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thisComponentPlan%rowComm = rowCommunicator |
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thisComponentPlan%columnComm = columnCommunicator |
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thisComponentPlan%rowIndex = rowIndex |
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thisComponentPlan%columnIndex = columnIndex |
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thisComponentPlan%numberRows = nRows |
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thisComponentPlan%numberColumns = nColumns |
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end subroutine make_Force_Grid |
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!! initalizes a gather scatter plan |
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subroutine plan_gather_scatter( nDim,nComponents,thisComponentPlan, & |
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thisComm, this_plan,status) |
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integer, intent(in) :: nDim !! Number of dimensions for gather scatter plan |
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integer, intent(in) :: nComponents |
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type (mpiComponentPlan), intent(in), target :: thisComponentPlan |
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type (gs_plan), intent(out) :: this_plan !! MPI Component Plan |
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integer, intent(in) :: thisComm !! MPI communicator for this plan |
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integer :: arraySize !! size to allocate plan for |
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integer, intent(out), optional :: status |
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integer :: ierror |
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integer :: i,junk |
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if (present(status)) status = 0 |
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!! Set gsComponetPlan pointer |
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!! to the componet plan we want to use for this gather scatter plan. |
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!! WARNING this could be dangerous since thisComponentPlan was origionally |
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!! allocated in C++ and there is a significant difference between c and |
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!! f95 pointers.... |
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gsComponentPlan => thisComponetPlan |
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! Set this plan size for displs array. |
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this_plan%gsPlanSize = nDim * nComponents |
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! Duplicate communicator for this plan |
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call mpi_comm_dup(thisComm,this_plan%myPlanComm,mpi_err) |
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if (mpi_err /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
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call mpi_comm_rank(this_plan%myPlanComm,this_plan%myPlanRank,mpi_err) |
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if (mpi_err /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
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call mpi_comm_size(this_plan%myPlanComm,this_plan%planNprocs,mpi_err) |
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if (mpi_err /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
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!! counts and displacements arrays are indexed from 0 to be compatable |
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!! with MPI arrays. |
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allocate (this_plan%counts(0:this_plan%planNprocs-1),STAT=ierror) |
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if (ierror /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
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allocate (this_plan%displs(0:this_plan%planNprocs-1),STAT=ierror) |
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if (ierror /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
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!! gather all the local sizes into a size # processors array. |
390 |
chuckv |
253 |
call mpi_allgather(this_plan%gsPlanSize,1,mpi_integer,this_plan%counts, & |
391 |
chuckv |
215 |
1,mpi_integer,comm,mpi_err) |
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if (mpi_err /= 0) then |
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if (present(status)) status = -1 |
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return |
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end if |
397 |
|
|
|
398 |
|
|
|
399 |
|
|
!! figure out the total number of particles in this plan |
400 |
|
|
this_plan%globalPlanSize = sum(this_plan%counts) |
401 |
|
|
|
402 |
|
|
|
403 |
|
|
!! initialize plan displacements. |
404 |
|
|
this_plan%displs(0) = 0 |
405 |
|
|
do i = 1, this_plan%planNprocs - 1,1 |
406 |
|
|
this_plan%displs(i) = this_plan%displs(i-1) + this_plan%counts(i-1) |
407 |
|
|
end do |
408 |
|
|
|
409 |
|
|
end subroutine plan_gather_scatter |
410 |
|
|
|
411 |
|
|
|
412 |
|
|
subroutine unplan_gather_scatter(this_plan) |
413 |
|
|
type (gs_plan), intent(inout) :: this_plan |
414 |
|
|
|
415 |
|
|
|
416 |
|
|
this_plan%gsComponentPlan => null() |
417 |
chuckv |
253 |
call mpi_comm_free(this_plan%myPlanComm,mpi_err) |
418 |
chuckv |
215 |
|
419 |
|
|
deallocate(this_plan%counts) |
420 |
|
|
deallocate(this_plan%displs) |
421 |
|
|
|
422 |
|
|
end subroutine unplan_gather_scatter |
423 |
|
|
|
424 |
|
|
subroutine gather_integer( sbuffer, rbuffer, this_plan, status) |
425 |
|
|
|
426 |
|
|
type (gs_plan), intent(in) :: this_plan |
427 |
|
|
integer, dimension(:), intent(in) :: sbuffer |
428 |
|
|
integer, dimension(:), intent(in) :: rbuffer |
429 |
|
|
integer :: noffset |
430 |
|
|
integer, intent(out), optional :: status |
431 |
|
|
|
432 |
|
|
if (present(status)) status = 0 |
433 |
|
|
noffset = this_plan%displs(this_plan%myPlanRank) |
434 |
|
|
|
435 |
|
|
call mpi_allgatherv(sbuffer,this_plan%gsPlanSize, mpi_integer, & |
436 |
|
|
rbuffer,this_plan%counts,this_plan%displs,mpi_integer, & |
437 |
|
|
this_plan%myPlanComm, mpi_err) |
438 |
|
|
|
439 |
|
|
if (mpi_err /= 0) then |
440 |
|
|
if (present(status)) status = -1 |
441 |
|
|
endif |
442 |
|
|
|
443 |
|
|
end subroutine gather_integer |
444 |
|
|
|
445 |
|
|
subroutine gather_double( sbuffer, rbuffer, this_plan, status) |
446 |
|
|
|
447 |
|
|
type (gs_plan), intent(in) :: this_plan |
448 |
|
|
real( kind = DP ), dimension(:), intent(in) :: sbuffer |
449 |
|
|
real( kind = DP ), dimension(:), intent(in) :: rbuffer |
450 |
|
|
integer :: noffset |
451 |
|
|
integer, intent(out), optional :: status |
452 |
|
|
|
453 |
|
|
if (present(status)) status = 0 |
454 |
chuckv |
253 |
noffset = this_plan%displs(this_plan%myPlanRank) |
455 |
chuckv |
215 |
|
456 |
|
|
call mpi_allgatherv(sbuffer,this_plan%gsPlanSize, mpi_double_precision, & |
457 |
|
|
rbuffer,this_plan%counts,this_plan%displs,mpi_double_precision, & |
458 |
|
|
this_plan%myPlanComm, mpi_err) |
459 |
|
|
|
460 |
|
|
if (mpi_err /= 0) then |
461 |
|
|
if (present(status)) status = -1 |
462 |
|
|
endif |
463 |
|
|
|
464 |
|
|
end subroutine gather_double |
465 |
|
|
|
466 |
|
|
subroutine gather_double_2d( sbuffer, rbuffer, this_plan, status) |
467 |
|
|
|
468 |
|
|
type (gs_plan), intent(in) :: this_plan |
469 |
|
|
real( kind = DP ), dimension(:,:), intent(in) :: sbuffer |
470 |
|
|
real( kind = DP ), dimension(:,:), intent(in) :: rbuffer |
471 |
|
|
integer :: noffset,i,ierror |
472 |
|
|
integer, intent(out), optional :: status |
473 |
|
|
|
474 |
|
|
external mpi_allgatherv |
475 |
|
|
|
476 |
|
|
if (present(status)) status = 0 |
477 |
|
|
|
478 |
|
|
! noffset = this_plan%displs(this_plan%me) |
479 |
|
|
|
480 |
|
|
call mpi_allgatherv(sbuffer,this_plan%gsPlanSize, mpi_double_precision, & |
481 |
|
|
rbuffer,this_plan%counts,this_plan%displs,mpi_double_precision, & |
482 |
|
|
this_plan%myPlanComm, mpi_err) |
483 |
|
|
|
484 |
|
|
if (mpi_err /= 0) then |
485 |
|
|
if (present(status)) status = -1 |
486 |
|
|
endif |
487 |
|
|
|
488 |
|
|
end subroutine gather_double_2d |
489 |
|
|
|
490 |
|
|
subroutine scatter_double( sbuffer, rbuffer, this_plan, status) |
491 |
|
|
|
492 |
|
|
type (gs_plan), intent(in) :: this_plan |
493 |
|
|
real( kind = DP ), dimension(:), intent(in) :: sbuffer |
494 |
|
|
real( kind = DP ), dimension(:), intent(in) :: rbuffer |
495 |
|
|
integer, intent(out), optional :: status |
496 |
|
|
external mpi_reduce_scatter |
497 |
|
|
|
498 |
|
|
if (present(status)) status = 0 |
499 |
|
|
|
500 |
|
|
call mpi_reduce_scatter(sbuffer,rbuffer, this_plan%counts, & |
501 |
|
|
mpi_double_precision, MPI_SUM, this_plan%myPlanComm, mpi_err) |
502 |
|
|
|
503 |
|
|
if (mpi_err /= 0) then |
504 |
|
|
if (present(status)) status = -1 |
505 |
|
|
endif |
506 |
|
|
|
507 |
|
|
end subroutine scatter_double |
508 |
|
|
|
509 |
|
|
subroutine scatter_double_2d( sbuffer, rbuffer, this_plan, status) |
510 |
|
|
|
511 |
|
|
type (gs_plan), intent(in) :: this_plan |
512 |
|
|
real( kind = DP ), dimension(:,:), intent(in) :: sbuffer |
513 |
|
|
real( kind = DP ), dimension(:,:), intent(in) :: rbuffer |
514 |
|
|
integer, intent(out), optional :: status |
515 |
|
|
external mpi_reduce_scatter |
516 |
|
|
|
517 |
|
|
if (present(status)) status = 0 |
518 |
|
|
call mpi_reduce_scatter(sbuffer,rbuffer, this_plan%counts, & |
519 |
|
|
mpi_double_precision, MPI_SUM, this_plan%myPlanComm, mpi_err) |
520 |
|
|
|
521 |
|
|
if (mpi_err /= 0) then |
522 |
|
|
if (present(status)) status = -1 |
523 |
|
|
endif |
524 |
|
|
|
525 |
|
|
end subroutine scatter_double_2d |
526 |
|
|
|
527 |
chuckv |
230 |
|
528 |
chuckv |
239 |
subroutine setTags(tags,status) |
529 |
chuckv |
253 |
integer, dimension(:) :: tags |
530 |
chuckv |
239 |
integer :: status |
531 |
|
|
|
532 |
|
|
integer :: alloc_stat |
533 |
|
|
|
534 |
chuckv |
253 |
integer :: ncol |
535 |
|
|
integer :: nrow |
536 |
|
|
|
537 |
chuckv |
239 |
status = 0 |
538 |
|
|
! allocate row arrays |
539 |
chuckv |
253 |
nrow = getNrow(plan_row) |
540 |
|
|
ncol = getNcol(plan_col) |
541 |
|
|
|
542 |
chuckv |
239 |
if (.not. allocated(tagRow)) then |
543 |
chuckv |
253 |
allocate(tagRow(nrow),STAT=alloc_stat) |
544 |
chuckv |
239 |
if (alloc_stat /= 0 ) then |
545 |
|
|
status = -1 |
546 |
|
|
return |
547 |
|
|
endif |
548 |
|
|
else |
549 |
|
|
deallocate(tagRow) |
550 |
chuckv |
253 |
allocate(tagRow(nrow),STAT=alloc_stat) |
551 |
chuckv |
239 |
if (alloc_stat /= 0 ) then |
552 |
|
|
status = -1 |
553 |
|
|
return |
554 |
|
|
endif |
555 |
|
|
|
556 |
|
|
endif |
557 |
|
|
! allocate column arrays |
558 |
|
|
if (.not. allocated(tagCol)) then |
559 |
chuckv |
253 |
allocate(tagColumn(ncol),STAT=alloc_stat) |
560 |
chuckv |
239 |
if (alloc_stat /= 0 ) then |
561 |
|
|
status = -1 |
562 |
|
|
return |
563 |
|
|
endif |
564 |
|
|
else |
565 |
chuckv |
253 |
deallocate(tagColumn) |
566 |
|
|
allocate(tagColumn(ncol),STAT=alloc_stat) |
567 |
chuckv |
239 |
if (alloc_stat /= 0 ) then |
568 |
|
|
status = -1 |
569 |
|
|
return |
570 |
|
|
endif |
571 |
|
|
endif |
572 |
|
|
|
573 |
|
|
call gather(tags,tagRow,plan_row) |
574 |
chuckv |
253 |
call gather(tags,tagColumn,plan_col) |
575 |
chuckv |
239 |
|
576 |
|
|
|
577 |
|
|
end subroutine setTags |
578 |
|
|
|
579 |
chuckv |
253 |
pure function getNcol(thisplan) result(ncol) |
580 |
|
|
type (gs_plan), intent(in) :: thisplan |
581 |
chuckv |
230 |
integer :: ncol |
582 |
chuckv |
253 |
ncol = thisplan%gsComponentPlan%nComponentsColumn |
583 |
chuckv |
230 |
end function getNcol |
584 |
|
|
|
585 |
chuckv |
253 |
pure function getNrow(thisplan) result(ncol) |
586 |
|
|
type (gs_plan), intent(in) :: thisplan |
587 |
chuckv |
230 |
integer :: ncol |
588 |
|
|
ncol = thisplan%gsComponentPlan%nComponentsrow |
589 |
|
|
end function getNrow |
590 |
|
|
|
591 |
chuckv |
253 |
function isMPISimSet() result(isthisSimSet) |
592 |
chuckv |
239 |
logical :: isthisSimSet |
593 |
|
|
if (isSimSet) then |
594 |
|
|
isthisSimSet = .true. |
595 |
|
|
else |
596 |
|
|
isthisSimSet = .false. |
597 |
|
|
endif |
598 |
|
|
end function isMPISimSet |
599 |
chuckv |
215 |
|
600 |
chuckv |
230 |
|
601 |
|
|
|
602 |
chuckv |
215 |
#endif |
603 |
|
|
end module mpiSimulation |
604 |
|
|
|