#!/usr/bin/env python3 import os import sys from optparse import OptionParser import numpy as np import damask scriptName = os.path.splitext(os.path.basename(__file__))[0] scriptID = ' '.join([scriptName,damask.version]) # -------------------------------------------------------------------- # MAIN # -------------------------------------------------------------------- parser = OptionParser(option_class=damask.extendableOption, usage='%prog options [file[s]]', description = """ Create seeds file by poking at 45 degree through given geom file. Mimics APS Beamline 34-ID-E DAXM poking. """, version = scriptID) parser.add_option('-N', '--points', dest = 'N', type = 'int', metavar = 'int', help = 'number of poking locations [%default]') parser.add_option('-b', '--box', dest = 'box', type = 'float', nargs = 6, metavar = ' '.join(['float']*6), help = 'bounding box as fraction in x, y, and z directions') parser.add_option('-x', action = 'store_true', dest = 'x', help = 'poke 45 deg along x') parser.add_option('-y', action = 'store_true', dest = 'y', help = 'poke 45 deg along y') parser.set_defaults(x = False, y = False, box = [0.0,1.0,0.0,1.0,0.0,1.0], N = 16, ) (options,filenames) = parser.parse_args() if filenames == []: filenames = [None] options.box = np.array(options.box).reshape(3,2) for name in filenames: damask.util.report(scriptName,name) geom = damask.Geom.from_file(StringIO(''.join(sys.stdin.read())) if name is None else name) table = damask.ASCIItable(name = name, outname = os.path.splitext(name)[-2]+'_poked_{}.seeds'.format(options.N) if name else name, buffered = False, labeled = False) table.head_read() info,extra_header = table.head_getGeom() grid = info['grid'] size = info['size'] offset =(np.amin(options.box, axis=1)*geom.grid/geom.size).astype(int) box = np.amax(options.box, axis=1) \ - np.amin(options.box, axis=1) Nx = int(options.N/np.sqrt(options.N*geom.size[1]*box[1]/geom.size[0]/box[0])) Ny = int(options.N/np.sqrt(options.N*geom.size[0]*box[0]/geom.size[1]/box[1])) Nz = int(box[2]*geom.grid[2]) damask.util.croak('poking {} x {} x {} in box {} {} {}...'.format(Nx,Ny,Nz,*box)) seeds = np.zeros((Nx*Ny*Nz,4),'d') g = np.zeros(3,'i') n = 0 for i in range(Nx): for j in range(Ny): g[0] = round((i+0.5)*box[0]*grid[0]/Nx-0.5)+offset[0] g[1] = round((j+0.5)*box[1]*grid[1]/Ny-0.5)+offset[1] for k in range(Nz): g[2] = k + offset[2] g %= grid seeds[n,0:3] = (g+0.5)/grid # normalize coordinates to box seeds[n, 3] = geom.microstructure[g[0],g[1],g[2]] if options.x: g[0] += 1 if options.y: g[1] += 1 n += 1 # ------------------------------------------ assemble header --------------------------------------- table.info_clear() table.info_append(geom.comments+[ scriptID + ' ' + ' '.join(sys.argv[1:]), "poking\ta {}\tb {}\tc {}".format(Nx,Ny,Nz), "grid\ta {}\tb {}\tc {}".format(*geom.grid), "size\tx {}\ty {}\tz {}".format(*geom.size), "origin\tx {}\ty {}\tz {}".format(*geom.origin), "homogenization\t{}".format(info['homogenization']), ]) table.labels_clear() table.labels_append(['{dim}_{label}'.format(dim = 1+i,label = 'pos') for i in range(3)]+['microstructure']) table.head_write() table.output_flush() # --- write seeds information ------------------------------------------------------------ table.data = seeds table.data_writeArray() # --- output finalization -------------------------------------------------------------------------- table.close() # close ASCII table