#!/usr/bin/env python # -*- coding: UTF-8 no BOM -*- import os,sys,string,math,numpy from optparse import OptionParser, OptionGroup, Option, SUPPRESS_HELP # ----------------------------- class extendedOption(Option): # ----------------------------- # used for definition of new option parser action 'extend', which enables to take multiple option arguments # taken from online tutorial http://docs.python.org/library/optparse.html ACTIONS = Option.ACTIONS + ("extend",) STORE_ACTIONS = Option.STORE_ACTIONS + ("extend",) TYPED_ACTIONS = Option.TYPED_ACTIONS + ("extend",) ALWAYS_TYPED_ACTIONS = Option.ALWAYS_TYPED_ACTIONS + ("extend",) def take_action(self, action, dest, opt, value, values, parser): if action == "extend": lvalue = value.split(",") values.ensure_value(dest, []).extend(lvalue) else: Option.take_action(self, action, dest, opt, value, values, parser) # ----------------------- MAIN ------------------------------- minimal_surfaces = ['primitive','gyroid','diamond',] surface = { 'primitive': lambda x,y,z: math.cos(x)+math.cos(y)+math.cos(z), 'gyroid': lambda x,y,z: math.sin(x)*math.cos(y)+math.sin(y)*math.cos(z)+math.cos(x)*math.sin(z), 'diamond': lambda x,y,z: math.cos(x-y)*math.cos(z)+math.sin(x+y)*math.sin(z), } parser = OptionParser(option_class=extendedOption, usage='%prog', description = """ Generate a geometry file of a bicontinuous structure of given type. """ + string.replace('$Id$','\n','\\n') ) parser.add_option('-t','--type', dest='type', type='string', \ help='type of minimal surface (%s)'%(','.join(minimal_surfaces))) parser.add_option('-f','--threshold', dest='threshold', type='float', \ help='threshold value defining minimal surface [%default]') parser.add_option('-g', '--grid', dest='grid', type='int', nargs=3, \ help='a,b,c grid of hexahedral box %default') parser.add_option('-s', '--size', dest='size', type='float', nargs=3, \ help='x,y,z size of hexahedral box %default') parser.add_option('-p', '--periods', dest='periods', type='int', \ help='number of repetitions of unit cell [%default]') parser.add_option('--homogenization', dest='homogenization', type='int', \ help='homogenization index to be used [%defaults]') parser.add_option('--phase', dest='phase', type='int', nargs = 2, \ help='two phase indices to be used %default') parser.add_option('-2', '--twodimensional', dest='twoD', action='store_true', \ help='output geom file with two-dimensional data arrangement [%default]') parser.set_defaults(type = minimal_surfaces[0]) parser.set_defaults(threshold = 0.0) parser.set_defaults(periods = 1) parser.set_defaults(grid = numpy.array([16,16,16])) parser.set_defaults(size = numpy.array([1.0,1.0,1.0])) parser.set_defaults(homogenization = 1) parser.set_defaults(phase = [1,2]) parser.set_defaults(twoD = False) (options, args) = parser.parse_args() # ------------------------------------------ setup file handles --------------------------------------- file = {'name':'STDIN', 'input':sys.stdin, 'output':sys.stdout, 'croak':sys.stderr, } if numpy.any(options.grid < 1): file['croak'].write('invalid grid...\n') sys.exit() if numpy.any(options.size < 0.0): file['croak'].write('invalid size...\n') sys.exit() file['output'].write("6 header\n" + \ "$Id$\n" +\ "grid\ta %i\tb %i\tc %i\n"%(options.grid[0],options.grid[1],options.grid[2],) + \ "size\tx %g\ty %g\tz %g\n"%(options.size[0],options.size[1],options.size[2],) + \ "origin\tx 0\ty 0\tz 0\n" + \ "microstructures 2\n" +\ "homogenization %i\n"%options.homogenization ) for z in xrange(options.grid[2]): Z = options.periods*2.0*math.pi*(z+0.5)/options.grid[2] for y in xrange(options.grid[1]): Y = options.periods*2.0*math.pi*(y+0.5)/options.grid[1] for x in xrange(options.grid[0]): X = options.periods*2.0*math.pi*(x+0.5)/options.grid[0] file['output'].write(\ str({True:options.phase[0],False:options.phase[1]}[options.threshold > surface[options.type](X,Y,Z)]) + \ {True:' ',False:'\n'}[options.twoD] ) file['output'].write({True:'\n',False:''}[options.twoD])