# $Id: material.py 1507 2012-05-24 16:00:32Z MPIE\t.elachkar $ import re class Material(): ''' Reads, manipulates and writes material.config files See end of file for example of usage ''' __slots__ = ['data'] def __init__(self): self.parts = [ 'homogenization', 'microstructure', 'crystallite', 'phase', 'texture', ] # ordered (!) list of parts self.data = {\ 'homogenization': {'__order__': []}, 'microstructure': {'__order__': []}, 'crystallite': {'__order__': []}, 'phase': {'__order__': []}, 'texture': {'__order__': []}, } def __repr__(self): me = [] for part in self.parts: print('doing',part) me += ['','#-----------------------------#','<%s>'%part,'#-----------------------------#',] for section in self.data[part]['__order__']: section_number=self.data[part]['__order__'].index(section) if section_number>0 and section_number$') # pattern for part re_sec = re.compile(r'^\[(.+)\]$') # pattern for section name_section = '' idx_section = 0 active = False for line in content: line = line.split('#')[0].strip() # kill comments and extra whitespace line = line.split('#')[0].strip() # kill comments and extra whitespace if line: # content survives... match_part = re_part.match(line) if match_part: # found separator active = (match_part.group(1) == part) # only active in continue if active: match_sec = re_sec.match(line) if match_sec: # found [section] name_section = match_sec.group(1) # remember name ... if '__order__' not in self.data[part]: self.data[part]['__order__'] = [] self.data[part]['__order__'].append(name_section) # ... and position self.data[part][name_section] = {'__order__':[]} continue if sections == [] or name_section in sections: # respect subset items = line.split() if items[0] not in self.data[part][name_section]: # first encounter of key? self.data[part][name_section][items[0]] = [] # create item self.data[part][name_section]['__order__'].append(items[0]) if items[0].startswith('(') and items[0].endswith(')'): # multiple "(key)" self.data[part][name_section][items[0]].append(items[1:]) else: # plain key self.data[part][name_section][items[0]] = items[1:] def read(self,file=None): f=open(file,'r') c=f.readlines() f.close() for p in self.parts: self.parse_data(part=p, content=c) def write(self,file='material.config', overwrite=False): import os i = 0 saveFile = file while not overwrite and os.path.exists(saveFile): i += 1 saveFile = file+'_%i'%i print('Writing material data to file %s'%saveFile) f=open(saveFile,'w') f.write(str(self)+'\n') #newline at end f.close() return saveFile def add_section(self, part=None, section=None, object=None, merge = False): '''adding/updating''' if part not in self.parts: raise Exception('invalid part %s'%part) if type(object) is dict: data = object else: data = object.data() if section not in self.data[part]: self.data[part]['__order__'] += [section] if section in self.data[part] and merge: for existing in self.data[part][section]['__order__']: # replace existing if existing in data['__order__']: if existing.startswith('(') and existing.endswith(')'): # multiple (key) self.data[part][section][existing] += data[existing] # add new multiple entries to existing ones else: # regular key self.data[part][section][existing] = data[existing] # plain replice for new in data['__order__']: # merge new content if new not in self.data[part][section]['__order__']: self.data[part][section][new] = data[new] self.data[part][section]['__order__'] += [new] else: self.data[part][section] = data class Section(): def __init__(self,data = {'__order__':[]},part = ''): classes = { 'homogenization':Homogenization, 'microstructure':Microstructure, 'crystallite':Crystallite, 'phase':Phase, 'texture':Texture, } self.parameters = {} for key in data: if type(data[key]) is not list: self.parameters[key] = [data[key]] else: self.parameters[key] = data[key] if '__order__' not in self.parameters: self.parameters['__order__'] = self.parameters.keys() if part.lower() in classes: self.__class__ = classes[part.lower()] self.__init__(data) def add_multiKey(self,key,data): multiKey = '(%s)'%key if multiKey not in self.parameters: self.parameters[multiKey] = [] if multiKey not in self.parameters['__order__']: self.parameters['__order__'] += [multiKey] if type(data) == list: self.parameters[multiKey] += [[item] for item in data] else: self.parameters[multiKey] += [[data]] def add_key(self,key,data): if type(data) == list: self.parameters[key] = [item for item in data] else: self.parameters[key] = [data] if key not in self.parameters['__order__']: self.parameters['__order__'] += [key] def data(self): return self.parameters class Homogenization(Section): def __init__(self,data = {'__order__':[]}): Section.__init__(self,data) class Crystallite(Section): def __init__(self,data = {'__order__':[]}): Section.__init__(self,data) class Phase(Section): def __init__(self,data = {'__order__':[]}): Section.__init__(self,data) class Microstructure(Section): def __init__(self,data = {'__order__':[]}): Section.__init__(self,data) def add_constituent(self, data,): # dict of phase,texture, and fraction theData = '' for property in ['phase','texture','fraction']: if property not in data.keys(): # suboptimal!! print('Croak!') else: theData += '%s %s\t'%(property,data[property]) self.add_multiKey('constituent',theData) class Texture(Section): def __init__(self,data = {'__order__':[]}): Section.__init__(self,data) def add_component(self,theType,properties): if 'scatter' not in map(str.lower,properties.keys()): scatter = 0.0 else: scatter = properties['scatter'] if 'fraction' not in map(str.lower,properties.keys()): fraction = 1.0 else: fraction = properties['fraction'] multiKey = theType.lower() if multiKey == 'gauss': self.add_multiKey(multiKey,'phi1 %g\tPhi %g\tphi2 %g\tscatter %g\tfraction %g'%( properties['eulers'][0], properties['eulers'][1], properties['eulers'][2], scatter, fraction, ) ) if multiKey == 'fiber': self.add_multiKey(multiKey,'alpha1 %g\talpha2 %g\tbeta1 %g\tbeta2 %g\tscatter %g\tfraction %g'%( properties['eulers'][0], properties['eulers'][1], properties['eulers'][2], properties['eulers'][3], scatter, fraction, ) ) def example_1(write_file=False): '''Useage example of the material.config writer''' mat=Material() #--- CRYSTALLITE c=Crystallite() c.add_multiKey('output',['texture','orientation','grainorientation','f','p']) mat.add_section('crystallite','essential_output',c) #--- HOMOGENIZATION h=Homogenization() h.add_key('type','isostrain') h.add_key('Ngrains',1) mat.add_section('homogenization','homog1',h) #--- MICROSTRUCTURE m=Microstructure() m.add_key('crystallite','1') m.add_constituent({'phase':1,'texture':2,'fraction':1}) mat.add_section('microstructure','mustruct1',m) #--- TEXTURE t1=Texture() t1.add_component('gauss',{'eulers':[1,2,3],'fraction':0.5}) t1.add_component('gauss',{'eulers':[1,2,3],'scatter':2,'fraction':0.5}) mat.add_section('texture','tex_1',t1) t2=Texture() t2.add_component('gauss',{'eulers':[45,0,0]}) mat.add_section('texture','tex_2',t2) #t3=Texture() # ToDo: fibre texture #t3.add_component('fibre',{'eulers':[45,0,0]}) #mat.add_section('texture','tex_3',t3) #---PHASE p=Phase({'constitution':'lump'}) p.add_key('elasticity','hooke') p.add_key('plasticity','phenopowerlaw') p.add_key('c11','162.4e9') p.add_key('c12',92.4e9) p.add_key('Nslip',[12,0,0,0]) p.add_key('interaction_slipslip',[1]*27) mat.add_section('phase','phase_label',p) print(mat) mat.write(file='material.config_example_1') mat.write(file='material.config_example_1',overwrite=True) return mat