!-------------------------------------------------------------------------------------------------- !> @author Jaeyong Jung, Max-Planck-Institut für Eisenforschung GmbH !> @author Pratheek Shanthraj, Max-Planck-Institut für Eisenforschung GmbH !> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH !> @author Philip Eisenlohr, Max-Planck-Institut für Eisenforschung GmbH !> @brief Interfacing between the PETSc-based solvers and the material subroutines provided !! by DAMASK !> @details Interfacing between the PETSc-based solvers and the material subroutines provided !> by DAMASK. Interpretating the command line arguments to get load case, geometry file, !> and working directory. !-------------------------------------------------------------------------------------------------- #define GCC_MIN 6 #define INTEL_MIN 1700 #define PETSC_MAJOR 3 #define PETSC_MINOR_MIN 10 #define PETSC_MINOR_MAX 12 module DAMASK_interface use, intrinsic :: iso_fortran_env use PETScSys use prec use system_routines implicit none private logical, public, protected :: & SIGTERM, & !< termination signal SIGUSR1, & !< 1. user-defined signal SIGUSR2 !< 2. user-defined signal integer, public, protected :: & interface_restartInc = 0 !< Increment at which calculation starts character(len=1024), public, protected :: & geometryFile = '', & !< parameter given for geometry file loadCaseFile = '' !< parameter given for load case file public :: & getSolverJobName, & DAMASK_interface_init, & setSIGTERM, & setSIGUSR1, & setSIGUSR2 contains !-------------------------------------------------------------------------------------------------- !> @brief initializes the solver by interpreting the command line arguments. Also writes !! information on computation to screen !-------------------------------------------------------------------------------------------------- subroutine DAMASK_interface_init #include #if defined(__GFORTRAN__) && __GNUC__PETSC_MINOR_MAX =================================================================================================== -- WRONG PETSc VERSION --- WRONG PETSc VERSION --- WRONG PETSc VERSION --- WRONG PETSc VERSION -- =================================================================================================== ============ THIS VERSION OF DAMASK REQUIRES A DIFFERENT PETSc VERSION ======================== =============== THIS VERSION OF DAMASK REQUIRES A DIFFERENT PETSc VERSION ===================== ================== THIS VERSION OF DAMASK REQUIRES A DIFFERENT PETSc VERSION ================== =================================================================================================== -- WRONG PETSc VERSION --- WRONG PETSc VERSION --- WRONG PETSc VERSION --- WRONG PETSc VERSION -- =================================================================================================== #endif character(len=1024) :: & commandLine, & !< command line call as string arg, & !< individual argument loadCaseArg = '', & !< -l argument given to the executable geometryArg = '', & !< -g argument given to the executable workingDirArg = '', & !< -w argument given to the executable userName !< name of user calling the executable integer :: & stat, & i, & #ifdef _OPENMP threadLevel, & #endif worldrank = 0, & worldsize = 0, & typeSize integer, dimension(8) :: & dateAndTime integer :: mpi_err PetscErrorCode :: petsc_err external :: & quit open(6, encoding='UTF-8') ! for special characters in output !-------------------------------------------------------------------------------------------------- ! PETSc Init #ifdef _OPENMP ! If openMP is enabled, check if the MPI libary supports it and initialize accordingly. ! Otherwise, the first call to PETSc will do the initialization. call MPI_Init_Thread(MPI_THREAD_FUNNELED,threadLevel,mpi_err) if (mpi_err /= 0) call quit(1) if (threadLevel>>' ! http://patorjk.com/software/taag/#p=display&f=Lean&t=DAMASK write(6,*) achar(27)//'[94m' write(6,*) ' _/_/_/ _/_/ _/ _/ _/_/ _/_/_/ _/ _/' write(6,*) ' _/ _/ _/ _/ _/_/ _/_/ _/ _/ _/ _/ _/' write(6,*) ' _/ _/ _/_/_/_/ _/ _/ _/ _/_/_/_/ _/_/ _/_/' write(6,*) ' _/ _/ _/ _/ _/ _/ _/ _/ _/ _/ _/' write(6,*) ' _/_/_/ _/ _/ _/ _/ _/ _/ _/_/_/ _/ _/' write(6,*) achar(27)//'[0m' write(6,'(/,a)') ' Roters et al., Computational Materials Science 158:420–478, 2019' write(6,'(a)') ' https://doi.org/10.1016/j.commatsci.2018.04.030' write(6,'(/,a)') ' Version: '//DAMASKVERSION ! https://github.com/jeffhammond/HPCInfo/blob/master/docs/Preprocessor-Macros.md #if defined(__GFORTRAN__) || __INTEL_COMPILER >= 1800 write(6,'(/,a)') ' Compiled with: '//compiler_version() write(6,'(a)') ' Compiler options: '//compiler_options() #elif defined(__INTEL_COMPILER) write(6,'(/,a,i4.4,a,i8.8)') ' Compiled with Intel fortran version :', __INTEL_COMPILER,& ', build date :', __INTEL_COMPILER_BUILD_DATE #elif defined(__PGI) write(6,'(a,i4.4,a,i8.8)') ' Compiled with PGI fortran version :', __PGIC__,& '.', __PGIC_MINOR__ #endif write(6,'(/,a)') ' Compiled on: '//__DATE__//' at '//__TIME__ call date_and_time(values = dateAndTime) write(6,'(/,a,2(i2.2,a),i4.4)') ' Date: ',dateAndTime(3),'/',dateAndTime(2),'/', dateAndTime(1) write(6,'(a,2(i2.2,a),i2.2)') ' Time: ',dateAndTime(5),':', dateAndTime(6),':', dateAndTime(7) call MPI_Type_size(MPI_INTEGER,typeSize,mpi_err) if (mpi_err /= 0) call quit(1) if (typeSize*8 /= bit_size(0)) then write(6,'(a)') ' Mismatch between MPI and DAMASK integer' call quit(1) endif call MPI_Type_size(MPI_DOUBLE,typeSize,mpi_err) if (mpi_err /= 0) call quit(1) if (typeSize*8 /= storage_size(0.0_pReal)) then write(6,'(a)') ' Mismatch between MPI and DAMASK real' call quit(1) endif do i = 1, command_argument_count() call get_command_argument(i,arg) select case(trim(arg)) ! extract key case ('-h','--help') write(6,'(a)') ' #######################################################################' write(6,'(a)') ' DAMASK Command Line Interface:' write(6,'(a)') ' For PETSc-based solvers for the Düsseldorf Advanced Material Simulation Kit' write(6,'(a,/)')' #######################################################################' write(6,'(a,/)')' Valid command line switches:' write(6,'(a)') ' --geom (-g, --geometry)' write(6,'(a)') ' --load (-l, --loadcase)' write(6,'(a)') ' --workingdir (-w, --wd, --workingdirectory, -d, --directory)' write(6,'(a)') ' --restart (-r, --rs)' write(6,'(a)') ' --help (-h)' write(6,'(/,a)')' -----------------------------------------------------------------------' write(6,'(a)') ' Mandatory arguments:' write(6,'(/,a)')' --geom PathToGeomFile/NameOfGeom' write(6,'(a)') ' Specifies the location of the geometry definition file.' write(6,'(/,a)')' --load PathToLoadFile/NameOfLoadFile' write(6,'(a)') ' Specifies the location of the load case definition file.' write(6,'(/,a)')' -----------------------------------------------------------------------' write(6,'(a)') ' Optional arguments:' write(6,'(/,a)')' --workingdirectory PathToWorkingDirectory' write(6,'(a)') ' Specifies the working directory and overwrites the default ./' write(6,'(a)') ' Make sure the file "material.config" exists in the working' write(6,'(a)') ' directory.' write(6,'(a)') ' For further configuration place "numerics.config"' write(6,'(a)')' and "debug.config" in that directory.' write(6,'(/,a)')' --restart XX' write(6,'(a)') ' Reads in increment XX and continues with calculating' write(6,'(a)') ' increment XX+1 based on this.' write(6,'(a)') ' Appends to existing results file' write(6,'(a)') ' "NameOfGeom_NameOfLoadFile".' write(6,'(a)') ' Works only if the restart information for increment XX' write(6,'(a)') ' is available in the working directory.' write(6,'(/,a)')' -----------------------------------------------------------------------' write(6,'(a)') ' Help:' write(6,'(/,a)')' --help' write(6,'(a,/)')' Prints this message and exits' call quit(0) ! normal Termination case ('-l', '--load', '--loadcase') call get_command_argument(i+1,loadCaseArg) case ('-g', '--geom', '--geometry') call get_command_argument(i+1,geometryArg) case ('-w', '-d', '--wd', '--directory', '--workingdir', '--workingdirectory') call get_command_argument(i+1,workingDirArg) case ('-r', '--rs', '--restart') call get_command_argument(i+1,arg) read(arg,*,iostat=stat) interface_restartInc if (interface_restartInc < 0 .or. stat /=0) then write(6,'(/,a)') ' ERROR: Could not parse restart increment: '//trim(arg) call quit(1) endif end select enddo if (len_trim(loadcaseArg) == 0 .or. len_trim(geometryArg) == 0) then write(6,'(/,a)') ' ERROR: Please specify geometry AND load case (-h for help)' call quit(1) endif if (len_trim(workingDirArg) > 0) call setWorkingDirectory(trim(workingDirArg)) geometryFile = getGeometryFile(geometryArg) loadCaseFile = getLoadCaseFile(loadCaseArg) call get_command(commandLine) call get_environment_variable('USER',userName) ! ToDo: https://stackoverflow.com/questions/8953424/how-to-get-the-username-in-c-c-in-linux write(6,'(/,a,i4.1)') ' MPI processes: ',worldsize write(6,'(a,a)') ' Host name: ', trim(getHostName()) write(6,'(a,a)') ' User name: ', trim(userName) write(6,'(/a,a)') ' Command line call: ', trim(commandLine) if (len(trim(workingDirArg)) > 0) & write(6,'(a,a)') ' Working dir argument: ', trim(workingDirArg) write(6,'(a,a)') ' Geometry argument: ', trim(geometryArg) write(6,'(a,a)') ' Load case argument: ', trim(loadcaseArg) write(6,'(a,a)') ' Working directory: ', trim(getCWD()) write(6,'(a,a)') ' Geometry file: ', trim(geometryFile) write(6,'(a,a)') ' Loadcase file: ', trim(loadCaseFile) write(6,'(a,a)') ' Solver job name: ', trim(getSolverJobName()) if (interface_restartInc > 0) & write(6,'(a,i6.6)') ' Restart from increment: ', interface_restartInc !call signalterm_c(c_funloc(catchSIGTERM)) call signalusr1_c(c_funloc(catchSIGUSR1)) call signalusr2_c(c_funloc(catchSIGUSR2)) call setSIGTERM(.false.) call setSIGUSR1(.false.) call setSIGUSR2(.false.) end subroutine DAMASK_interface_init !-------------------------------------------------------------------------------------------------- !> @brief extract working directory from given argument or from location of geometry file, !! possibly converting relative arguments to absolut path !-------------------------------------------------------------------------------------------------- subroutine setWorkingDirectory(workingDirectoryArg) character(len=*), intent(in) :: workingDirectoryArg !< working directory argument character(len=1024) :: workingDirectory !< working directory argument logical :: error external :: quit absolutePath: if (workingDirectoryArg(1:1) == '/') then workingDirectory = workingDirectoryArg else absolutePath workingDirectory = getCWD() workingDirectory = trim(workingDirectory)//'/'//workingDirectoryArg endif absolutePath workingDirectory = trim(rectifyPath(workingDirectory)) error = setCWD(trim(workingDirectory)) if(error) then write(6,'(/,a)') ' ERROR: Working directory "'//trim(workingDirectory)//'" does not exist' call quit(1) endif end subroutine setWorkingDirectory !-------------------------------------------------------------------------------------------------- !> @brief solver job name (no extension) as combination of geometry and load case name !-------------------------------------------------------------------------------------------------- character(len=1024) function getSolverJobName() integer :: posExt,posSep posExt = scan(geometryFile,'.',back=.true.) posSep = scan(geometryFile,'/',back=.true.) getSolverJobName = geometryFile(posSep+1:posExt-1) posExt = scan(loadCaseFile,'.',back=.true.) posSep = scan(loadCaseFile,'/',back=.true.) getSolverJobName = trim(getSolverJobName)//'_'//loadCaseFile(posSep+1:posExt-1) end function getSolverJobName !-------------------------------------------------------------------------------------------------- !> @brief basename of geometry file with extension from command line arguments !-------------------------------------------------------------------------------------------------- character(len=1024) function getGeometryFile(geometryParameter) character(len=1024), intent(in) :: geometryParameter logical :: file_exists external :: quit getGeometryFile = trim(geometryParameter) if (scan(getGeometryFile,'/') /= 1) getGeometryFile = trim(getCWD())//'/'//trim(getGeometryFile) getGeometryFile = makeRelativePath(trim(getCWD()), getGeometryFile) inquire(file=trim(getGeometryFile), exist=file_exists) if (.not. file_exists) then write(6,'(/,a)') ' ERROR: Geometry file does not exists ('//trim(getGeometryFile)//')' call quit(1) endif end function getGeometryFile !-------------------------------------------------------------------------------------------------- !> @brief relative path of loadcase from command line arguments !-------------------------------------------------------------------------------------------------- character(len=1024) function getLoadCaseFile(loadCaseParameter) character(len=1024), intent(in) :: loadCaseParameter logical :: file_exists external :: quit getLoadCaseFile = trim(loadCaseParameter) if (scan(getLoadCaseFile,'/') /= 1) getLoadCaseFile = trim(getCWD())//'/'//trim(getLoadCaseFile) getLoadCaseFile = makeRelativePath(trim(getCWD()), getLoadCaseFile) inquire(file=trim(getLoadCaseFile), exist=file_exists) if (.not. file_exists) then write(6,'(/,a)') ' ERROR: Load case file does not exists ('//trim(getLoadCaseFile)//')' call quit(1) endif end function getLoadCaseFile !-------------------------------------------------------------------------------------------------- !> @brief remove ../, /./, and // from path. !> @details works only if absolute path is given !-------------------------------------------------------------------------------------------------- function rectifyPath(path) character(len=*) :: path character(len=1024) :: rectifyPath integer :: i,j,k,l !-------------------------------------------------------------------------------------------------- ! remove /./ from path rectifyPath = trim(path) l = len_trim(rectifyPath) do i = l,3,-1 if (rectifyPath(i-2:i) == '/./') rectifyPath(i-1:l) = rectifyPath(i+1:l)//' ' enddo !-------------------------------------------------------------------------------------------------- ! remove // from path l = len_trim(rectifyPath) do i = l,2,-1 if (rectifyPath(i-1:i) == '//') rectifyPath(i-1:l) = rectifyPath(i:l)//' ' enddo !-------------------------------------------------------------------------------------------------- ! remove ../ and corresponding directory from rectifyPath l = len_trim(rectifyPath) i = index(rectifyPath(i:l),'../') j = 0 do while (i > j) j = scan(rectifyPath(1:i-2),'/',back=.true.) rectifyPath(j+1:l) = rectifyPath(i+3:l)//repeat(' ',2+i-j) if (rectifyPath(j+1:j+1) == '/') then !search for '//' that appear in case of XXX/../../XXX k = len_trim(rectifyPath) rectifyPath(j+1:k-1) = rectifyPath(j+2:k) rectifyPath(k:k) = ' ' endif i = j+index(rectifyPath(j+1:l),'../') enddo if(len_trim(rectifyPath) == 0) rectifyPath = '/' end function rectifyPath !-------------------------------------------------------------------------------------------------- !> @brief relative path from absolute a to absolute b !-------------------------------------------------------------------------------------------------- character(len=1024) function makeRelativePath(a,b) character (len=*), intent(in) :: a,b character (len=1024) :: a_cleaned,b_cleaned integer :: i,posLastCommonSlash,remainingSlashes posLastCommonSlash = 0 remainingSlashes = 0 a_cleaned = rectifyPath(trim(a)//'/') b_cleaned = rectifyPath(b) do i = 1, min(1024,len_trim(a_cleaned),len_trim(rectifyPath(b_cleaned))) if (a_cleaned(i:i) /= b_cleaned(i:i)) exit if (a_cleaned(i:i) == '/') posLastCommonSlash = i enddo do i = posLastCommonSlash+1,len_trim(a_cleaned) if (a_cleaned(i:i) == '/') remainingSlashes = remainingSlashes + 1 enddo makeRelativePath = repeat('..'//'/',remainingSlashes)//b_cleaned(posLastCommonSlash+1:len_trim(b_cleaned)) end function makeRelativePath !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGTERM to .true. !-------------------------------------------------------------------------------------------------- subroutine catchSIGTERM(signal) bind(C) integer(C_INT), value :: signal SIGTERM = .true. write(6,'(a,i2.2,a)') ' received signal ',signal, ', set SIGTERM' end subroutine catchSIGTERM !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGTERM !-------------------------------------------------------------------------------------------------- subroutine setSIGTERM(state) logical, intent(in) :: state SIGTERM = state end subroutine setSIGTERM !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGUSR1 to .true. !-------------------------------------------------------------------------------------------------- subroutine catchSIGUSR1(signal) bind(C) integer(C_INT), value :: signal SIGUSR1 = .true. write(6,'(a,i2.2,a)') ' received signal ',signal, ', set SIGUSR1' end subroutine catchSIGUSR1 !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGUSR1 !-------------------------------------------------------------------------------------------------- subroutine setSIGUSR1(state) logical, intent(in) :: state SIGUSR1 = state end subroutine setSIGUSR1 !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGUSR2 to .true. if program receives SIGUSR2 !-------------------------------------------------------------------------------------------------- subroutine catchSIGUSR2(signal) bind(C) integer(C_INT), value :: signal SIGUSR2 = .true. write(6,'(a,i2.2,a)') ' received signal ',signal, ', set SIGUSR2' end subroutine catchSIGUSR2 !-------------------------------------------------------------------------------------------------- !> @brief sets global variable SIGUSR2 !-------------------------------------------------------------------------------------------------- subroutine setSIGUSR2(state) logical, intent(in) :: state SIGUSR2 = state end subroutine setSIGUSR2 end module