DAMASK_EICMD/processing/pre/voronoi small memory.f90

program voronoi
  use prec, only: pReal, pInt

  implicit none

  logical seed
  character(len=1024) name, format, format2, N_Digits
  character choice
  integer(pInt) a, b, c, ab, abc, abc_Red, N_Seeds, seedPoint, minDistance, myDistance, i, j, k, l, m, n, z
  integer(pInt), dimension(:), allocatable :: seedmap, grainMap, visual_Case
  integer(pInt) coordinates(3)
  real(pReal) grainEuler(3)
  real(pReal), parameter :: pi = 3.14159265358979323846264338327950288419716939937510_pReal
  real(pReal) randomSeed

  print*, '******************************************************************************'
  print*, '                    Spectral Method Problem Set-up'
  print*, '******************************************************************************'
  print*, ''
  print*, 'generates:'
  print*, '    * mesh file "_GIVEN_NAME_.mesh": Geometrical information for solver'
  print*, '    * material file "material.config": Orientation information for solver'
  print*, 'optional output:'
  print*, '    * view file "_GIVEN_NAME_2D.msh": Information for visualization in gmsh'
  print*, '    * view file "_GIVEN_NAME_3D.msh": Information for visualization in gmsh'
  print*, ''
  print*, 'hints:'
  print*, '    * a+b+c should not exeed 30'
  print*, '    * file extension is added to given name'
  print*, ''
  write(*, '(A)', advance = 'NO') 'Please enter value for a: '
  read(*, *), a
  write(*, '(A)', advance = 'NO') 'Please enter value for b: '
  read(*, *), b
  write(*, '(A)', advance = 'NO') 'Please enter value for c: '
  read(*, *), c
  write(*, '(A)', advance = 'NO') 'Please enter No. of Grains: '
  read(*, *), N_Seeds
  write(*, '(A)', advance = 'NO') 'Please enter name of mesh file: '
  read(*, *), name
  write(*, '(A)', advance = 'NO') 'Should the visualization files be generated (y/n)? '
  read(*, *), choice

! calculate No. of digits needed for name of the grains
  i = 1 + int( log10(real( N_Seeds )))
  write(N_Digits, *) i
  N_Digits = adjustl( N_Digits )

!write material.config header and add a microstructure entry for every grain
  open(20, file = trim(name)//('_material.config'))
  write(20, '(A)'), '<microstructure>'
  format = '(A, I'//trim(N_Digits)//'.'//trim(N_Digits)//', A)'
  format2 = '(A, I'//trim(N_Digits)//', A)'
  do i = 1, N_Seeds
    write(20, trim(format)), '[Grain', i, ']'
    write(20, '(A)'), 'crystallite	1'
    write(20, trim(format2)), '(constituent)  phase 1   texture ', i, '   fraction 1.0'
  end do

! get random euler angles for every grain, store them in grainEuler and write them to the material.config file
  format2 = '(A, F10.6, A, F10.6, A, F10.6, A)'
  write(20, '(/, A)'), '<texture>'
    do i = 1, N_Seeds
      call random_number(grainEuler(1))
      call random_number(grainEuler(2))
      call random_number(grainEuler(3))
      grainEuler(1) = (grainEuler(1)) * 360
      grainEuler(2) = acos(2.0_pReal * (grainEuler(2))-1.0_pReal) * 180/pi
      grainEuler(3) = grainEuler(3) * 360
      write(20, trim(format)), '[Grain', i, ']'
      write(20, trim(format2)), '(gauss)  phi1 ', grainEuler(1), '   Phi ', grainEuler(2), &
            &'   Phi2 ', grainEuler(3), '   scatter 0   fraction 1'
    end do
  close(20)
  print*, ''
  print*, 'material config file is written out'

!write header of mesh file, should be done before the following change of variables
  open(20, file = ((trim(name))//'.mesh'))
  write(20, '(A, I2, A, I2, A, I2)'), 'resolution  a ', 2**a, '  b ', 2**b, '  c ', 2**c
  write(20, '(A, I4, A, I4, A, I4)'), 'dimension   x ', 2**a, '  y ', 2**b, '  z ', 2**c
  write(20, '(A)'), 'homogenization  1'

!initialize varibles, change values of some numbers for faster execution
  a = 2**a
  b = 2**b
  c = 2**c
  ab = a * b
  abc = a * b * c
  abc_Red = abc -(a-1)*(b-1)*(c-1)
  format = '(I'//trim(N_Digits)//'.'//trim(N_Digits)//')'

  allocate (seedmap(3 * N_Seeds)); seedmap = 0
  allocate (grainMap(abc_Red))
  allocate (visual_Case(abc_Red))
  k = 1

!build array with x-y-z-coordinates of each point
  do i = 1, abc
    coordinates(1) = mod((i-1), a) +1
    coordinates(2) = mod(((i-1)/a), b) +1
    coordinates(3) = mod(((i-1)/(ab)), c) +1
    if((coordinates(3) == 1)) then
      visual_Case(k) = i
      k = k +1
    else
      if((coordinates(2) == 1)) then
        visual_Case(k) = i
        k = k +1
      else
        if((coordinates(1) == 1)) then
          visual_Case(k) = i
          k = k +1
        else
        end if
      end if
    end if
  end do

!generate random position of seeds for voronoi tessellation
  i = 0
  do while (i /= N_Seeds)
    call random_number(randomSeed)
    seedpoint = int(randomSeed*(abc))
    seed = .false.
    coordinates(1) = mod((seedpoint), a) +1
    coordinates(2) = mod(((seedpoint)/a), b) +1
    coordinates(3) = mod(((seedpoint)/(ab)), c) +1
    do j = 1, i
      if((coordinates(1) == seedmap(j*3 -2)) .and. &
	    &(coordinates(2) == seedmap(j*3 -1)) .and. &
	    &(coordinates(3) == seedmap(j*3 -0))) seed = .true.
    end do
    if (.not.seed) then
      seedmap(i*3 +1) = coordinates(1)
      seedmap(i*3 +2) = coordinates(2)
      seedmap(i*3 +3) = coordinates(3)
      i = i +1
    end if
  end do

! perform voronoi tessellation and write result to file and to grainMap
  n = 1
  do i = 1, abc
    minDistance = a*a+b*b+c*c
    do j = 1, N_Seeds
      do k = -1, 1
        do l = -1, 1
          do m = -1, 1
            myDistance = ((mod((i-1), a) +1-seedmap(j*3-2)+m*a)**2+&
                     (mod(((i-1)/a), b) +1-seedmap(j*3-1)+l*b)**2+&
                     (mod(((i-1)/(ab)), c) +1-seedmap(j*3-0)+k*c)**2)
            if (myDistance < minDistance) then
              minDistance = myDistance
              z = j
            end if
          end do
        end do
      end do
    end do
    write(20, format), z
    do k = 1, abc_Red
      if(visual_Case(k) == i) then
      grainMap(n) = z
      n = n +1
      end if
    end do
  end do
  close(20)
  print*, 'voronoi tesselation finished'
  print*, 'mesh file is written out'

!write visualization files (in case wanted)
  if (choice == 'y' .or. choice == 'Y') then
    print*, 'for more information on gmsh: http://geuz.org/gmsh/'
	
! write full mesh out
    open(20, file = ((trim(name))//'_3D.msh'))
    write(20, '(A, /, A, /, A, /, A, /, I10)'), '$MeshFormat', '2.1 0 8', '$EndMeshFormat', '$Nodes', abc_Red
    do j = 1, abc_Red
      i = visual_Case(j)
      write(20, '(I10, I10, I10, I10)'), i, mod((i-1), a) +1, mod(((i-1)/a), b) +1, mod(((i-1)/(ab)), c) +1
    end do
    write(20, '(A, /, A, /, I10)'), '$EndNodes', '$Elements', abc_Red
    do j = 1, abc_Red
      write(20, '(I10, A, I10, A, I10)'), visual_Case(j), ' 15 2', grainMap(j), ' 2', visual_Case(j)
    end do
    write(20, '(A)'), '$EndElements'
    write(20, '(A, /, A, /, A, /, A, /, A, /, A, /, A, /, A, /, I10)'), '$NodeData', '1', '"Grain No."', '1', &
                                                                 &'0.0', '3', '0', '1', abc_Red
    do j = 1, abc_Red
      write(20, '(I10, tr2, I10)'), visual_Case(j), grainMap(j)
    end do
    write(20, *), '$EndNodeData'
    close(20)

! write 2d mesh out
    open(20, file = ((trim(name))//'_2D.msh'))
    write(20, '(A, /, A, /, A, /, A, /, I10)'), '$MeshFormat', '2.1 0 8', '$EndMeshFormat', '$Nodes', ab
    do i = 1, ab
      write(20, '(I10, I10, I10, I10)'), i, mod((i-1), a) +1, mod(((i-1)/a), b) +1, mod(((i-1)/(ab)), c) +1
    end do
    write(20, '(A, /, A, /, I10)'), '$EndNodes', '$Elements', ab
    do j = 1, ab
      write(20, '(I10, A, I10, A, I10)'), j, ' 15 2', grainMap(j), ' 2', j
    end do
    write(20, '(A)'), '$EndElements'
    write(20, '(A, /, A, /, A, /, A, /, A, /, A, /, A, /, A, /, I10)'), '$NodeData', '1', '"Grain No."', &
                                                    &'1', '0.0', '3', '0', '1', ab
    do j = 1, ab
      write(20, '(I10, tr2, I10)'), j, grainMap(j)
    end do
    write(20, *), '$EndNodeData'
    close(20)
    print*, 'visualization files are written out'
    else
  end if
end program voronoi