Merge remote-tracking branch 'origin/development' into MiscImprovements

This commit is contained in:
Martin Diehl 2020-03-01 07:32:00 +01:00
commit 08aef5531c
6 changed files with 375 additions and 484 deletions

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@ -104,7 +104,7 @@ checkout:
- release
###################################################################################################
Pytest:
Pytest_python:
stage: python
script:
- cd $DAMASKROOT/python
@ -385,6 +385,15 @@ Phenopowerlaw_singleSlip:
- master
- release
Pytest_grid:
stage: grid
script:
- cd pytest
- pytest
except:
- master
- release
###################################################################################################
Marc_compileIfort:
stage: compileMarc

@ -1 +1 @@
Subproject commit 6db5f4666fc651b4de3b44ceaed3f2b848170ac9
Subproject commit 9573ce7bd2c1a7188c1aac5b83aa76d480c2bdb0

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@ -1 +1 @@
v2.0.3-1747-ga2e8e5b1
v2.0.3-1808-g13c3ce00

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@ -1,49 +0,0 @@
[Aluminum]
elasticity hooke
plasticity phenopowerlaw
(output) resistance_slip
(output) shearrate_slip
(output) resolvedstress_slip
(output) accumulated_shear_slip
(output) resistance_twin
(output) shearrate_twin
(output) resolvedstress_twin
(output) accumulated_shear_twin
lattice_structure fcc
Nslip 12 # per family
Ntwin 0 # per family
c11 106.75e9
c12 60.41e9
c44 28.34e9
gdot0_slip 0.001
n_slip 20
tau0_slip 31e6 # per family
tausat_slip 63e6 # per family
a_slip 2.25
gdot0_twin 0.001
n_twin 20
tau0_twin 31e6 # per family
h0_slipslip 75e6
interaction_slipslip 1 1 1.4 1.4 1.4 1.4
atol_resistance 1
(stiffness_degradation) damage
(stiffness_degradation) porosity
{./Phase_Damage.config}
{./Phase_Thermal.config}
{./Phase_Vacancy.config}
{./Phase_Porosity.config}
{./Phase_Hydrogen.config}
{./Source_Damage_IsoBrittle.config}
{./Source_Thermal_Dissipation.config}
{./Source_Vacancy_PhenoPlasticity.config}
{./Source_Vacancy_Irradiation.config}
{./Kinematics_Thermal_Expansion.config}
{./Kinematics_Vacancy_Strain.config}
{./Kinematics_Hydrogen_Strain.config}

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@ -1,7 +1,8 @@
from queue import Queue
import multiprocessing
import re
import glob
import os
from functools import partial
import vtk
from vtk.util import numpy_support
@ -36,24 +37,23 @@ class DADF5():
with h5py.File(fname,'r') as f:
try:
self.version_major = f.attrs['DADF5_version_major']
self.version_minor = f.attrs['DADF5_version_minor']
self.version_major = f.attrs['DADF5_version_major']
self.version_minor = f.attrs['DADF5_version_minor']
except KeyError:
self.version_major = f.attrs['DADF5-major']
self.version_minor = f.attrs['DADF5-minor']
self.version_major = f.attrs['DADF5-major']
self.version_minor = f.attrs['DADF5-minor']
if self.version_major != 0 or not 2 <= self.version_minor <= 6:
raise TypeError('Unsupported DADF5 version {}.{} '.format(f.attrs['DADF5_version_major'],
f.attrs['DADF5_version_minor']))
raise TypeError('Unsupported DADF5 version {}.{} '.format(self.version_major,
self.version_minor))
self.structured = 'grid' in f['geometry'].attrs.keys()
if self.structured:
self.grid = f['geometry'].attrs['grid']
self.size = f['geometry'].attrs['size']
if self.version_major == 0 and self.version_minor >= 5:
self.origin = f['geometry'].attrs['origin']
self.grid = f['geometry'].attrs['grid']
self.size = f['geometry'].attrs['size']
self.origin = f['geometry'].attrs['origin'] if self.version_major == 0 and self.version_minor >= 5 else \
np.zeros(3)
r=re.compile('inc[0-9]+')
increments_unsorted = {int(i[3:]):i for i in f.keys() if r.match(i)}
@ -66,12 +66,12 @@ class DADF5():
self.con_physics = []
for c in self.constituents:
self.con_physics += f['/'.join([self.increments[0],'constituent',c])].keys()
self.con_physics += f['/'.join([self.increments[0],'constituent',c])].keys()
self.con_physics = list(set(self.con_physics)) # make unique
self.mat_physics = []
for m in self.materialpoints:
self.mat_physics += f['/'.join([self.increments[0],'materialpoint',m])].keys()
self.mat_physics += f['/'.join([self.increments[0],'materialpoint',m])].keys()
self.mat_physics = list(set(self.mat_physics)) # make unique
self.selection= {'increments': self.increments,
@ -446,6 +446,17 @@ class DADF5():
return f['geometry/x_c'][()]
@staticmethod
def _add_absolute(x):
return {
'data': np.abs(x['data']),
'label': '|{}|'.format(x['label']),
'meta': {
'Unit': x['meta']['Unit'],
'Description': 'Absolute value of {} ({})'.format(x['label'],x['meta']['Description']),
'Creator': 'dadf5.py:add_abs v{}'.format(version)
}
}
def add_absolute(self,x):
"""
Add absolute value.
@ -456,21 +467,24 @@ class DADF5():
Label of scalar, vector, or tensor dataset to take absolute value of.
"""
def _add_absolute(x):
return {
'data': np.abs(x['data']),
'label': '|{}|'.format(x['label']),
'meta': {
'Unit': x['meta']['Unit'],
'Description': 'Absolute value of {} ({})'.format(x['label'],x['meta']['Description']),
'Creator': 'dadf5.py:add_abs v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_absolute,{'x':x})
self._add_generic_pointwise(self._add_absolute,{'x':x})
@staticmethod
def _add_calculation(**kwargs):
formula = kwargs['formula']
for d in re.findall(r'#(.*?)#',formula):
formula = formula.replace('#{}#'.format(d),"kwargs['{}']['data']".format(d))
return {
'data': eval(formula),
'label': kwargs['label'],
'meta': {
'Unit': kwargs['unit'],
'Description': '{} (formula: {})'.format(kwargs['description'],kwargs['formula']),
'Creator': 'dadf5.py:add_calculation v{}'.format(version)
}
}
def add_calculation(self,label,formula,unit='n/a',description=None,vectorized=True):
"""
Add result of a general formula.
@ -492,28 +506,24 @@ class DADF5():
if not vectorized:
raise NotImplementedError
def _add_calculation(**kwargs):
formula = kwargs['formula']
for d in re.findall(r'#(.*?)#',formula):
formula = formula.replace('#{}#'.format(d),"kwargs['{}']['data']".format(d))
return {
'data': eval(formula),
'label': kwargs['label'],
'meta': {
'Unit': kwargs['unit'],
'Description': '{} (formula: {})'.format(kwargs['description'],kwargs['formula']),
'Creator': 'dadf5.py:add_calculation v{}'.format(version)
}
}
dataset_mapping = {d:d for d in set(re.findall(r'#(.*?)#',formula))} # datasets used in the formula
dataset_mapping = {d:d for d in set(re.findall(r'#(.*?)#',formula))} # datasets used in the formula
args = {'formula':formula,'label':label,'unit':unit,'description':description}
self.__add_generic_pointwise(_add_calculation,dataset_mapping,args)
self._add_generic_pointwise(self._add_calculation,dataset_mapping,args)
@staticmethod
def _add_Cauchy(P,F):
return {
'data': mechanics.Cauchy(P['data'],F['data']),
'label': 'sigma',
'meta': {
'Unit': P['meta']['Unit'],
'Description': 'Cauchy stress calculated from {} ({}) '.format(P['label'],
P['meta']['Description'])+\
'and {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_Cauchy v{}'.format(version)
}
}
def add_Cauchy(self,P='P',F='F'):
"""
Add Cauchy stress calculated from first Piola-Kirchhoff stress and deformation gradient.
@ -526,23 +536,20 @@ class DADF5():
Label of the dataset containing the deformation gradient. Defaults to F.
"""
def _add_Cauchy(P,F):
return {
'data': mechanics.Cauchy(P['data'],F['data']),
'label': 'sigma',
'meta': {
'Unit': P['meta']['Unit'],
'Description': 'Cauchy stress calculated from {} ({}) '.format(P['label'],
P['meta']['Description'])+\
'and {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_Cauchy v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_Cauchy,{'P':P,'F':F})
self._add_generic_pointwise(self._add_Cauchy,{'P':P,'F':F})
@staticmethod
def _add_determinant(T):
return {
'data': np.linalg.det(T['data']),
'label': 'det({})'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Determinant of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_determinant v{}'.format(version)
}
}
def add_determinant(self,T):
"""
Add the determinant of a tensor.
@ -553,21 +560,23 @@ class DADF5():
Label of tensor dataset.
"""
def _add_determinant(T):
return {
'data': np.linalg.det(T['data']),
'label': 'det({})'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Determinant of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_determinant v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_determinant,{'T':T})
self._add_generic_pointwise(self._add_determinant,{'T':T})
@staticmethod
def _add_deviator(T):
if not T['data'].shape[1:] == (3,3):
raise ValueError
return {
'data': mechanics.deviatoric_part(T['data']),
'label': 's_{}'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Deviator of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_deviator v{}'.format(version)
}
}
def add_deviator(self,T):
"""
Add the deviatoric part of a tensor.
@ -578,24 +587,20 @@ class DADF5():
Label of tensor dataset.
"""
def _add_deviator(T):
if not np.all(np.array(T['data'].shape[1:]) == np.array([3,3])):
raise ValueError
return {
'data': mechanics.deviatoric_part(T['data']),
'label': 's_{}'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Deviator of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_deviator v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_deviator,{'T':T})
self._add_generic_pointwise(self._add_deviator,{'T':T})
@staticmethod
def _add_eigenvalue(S):
return {
'data': mechanics.eigenvalues(S['data']),
'label': 'lambda({})'.format(S['label']),
'meta' : {
'Unit': S['meta']['Unit'],
'Description': 'Eigenvalues of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_eigenvalues v{}'.format(version)
}
}
def add_eigenvalues(self,S):
"""
Add eigenvalues of symmetric tensor.
@ -606,21 +611,20 @@ class DADF5():
Label of symmetric tensor dataset.
"""
def _add_eigenvalue(S):
return {
'data': mechanics.eigenvalues(S['data']),
'label': 'lambda({})'.format(S['label']),
'meta' : {
'Unit': S['meta']['Unit'],
'Description': 'Eigenvalues of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_eigenvalues v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_eigenvalue,{'S':S})
self._add_generic_pointwise(self._add_eigenvalue,{'S':S})
@staticmethod
def _add_eigenvector(S):
return {
'data': mechanics.eigenvectors(S['data']),
'label': 'v({})'.format(S['label']),
'meta' : {
'Unit': '1',
'Description': 'Eigenvectors of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_eigenvectors v{}'.format(version)
}
}
def add_eigenvectors(self,S):
"""
Add eigenvectors of symmetric tensor.
@ -631,21 +635,32 @@ class DADF5():
Label of symmetric tensor dataset.
"""
def _add_eigenvector(S):
return {
'data': mechanics.eigenvectors(S['data']),
'label': 'v({})'.format(S['label']),
'meta' : {
'Unit': '1',
'Description': 'Eigenvectors of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_eigenvectors v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_eigenvector,{'S':S})
self._add_generic_pointwise(self._add_eigenvector,{'S':S})
@staticmethod
def _add_IPFcolor(q,l):
d = np.array(l)
d_unit = d/np.linalg.norm(d)
m = util.scale_to_coprime(d)
colors = np.empty((len(q['data']),3),np.uint8)
lattice = q['meta']['Lattice']
for i,q in enumerate(q['data']):
o = Orientation(np.array([q['w'],q['x'],q['y'],q['z']]),lattice).reduced()
colors[i] = np.uint8(o.IPFcolor(d_unit)*255)
return {
'data': colors,
'label': 'IPFcolor_[{} {} {}]'.format(*m),
'meta' : {
'Unit': 'RGB (8bit)',
'Lattice': lattice,
'Description': 'Inverse Pole Figure (IPF) colors for direction/plane [{} {} {})'.format(*m),
'Creator': 'dadf5.py:add_IPFcolor v{}'.format(version)
}
}
def add_IPFcolor(self,q,l):
"""
Add RGB color tuple of inverse pole figure (IPF) color.
@ -658,33 +673,20 @@ class DADF5():
Lab frame direction for inverse pole figure.
"""
def _add_IPFcolor(q,l):
self._add_generic_pointwise(self._add_IPFcolor,{'q':q},{'l':l})
d = np.array(l)
d_unit = d/np.linalg.norm(d)
m = util.scale_to_coprime(d)
colors = np.empty((len(q['data']),3),np.uint8)
lattice = q['meta']['Lattice']
for i,q in enumerate(q['data']):
o = Orientation(np.array([q['w'],q['x'],q['y'],q['z']]),lattice).reduced()
colors[i] = np.uint8(o.IPFcolor(d_unit)*255)
return {
'data': colors,
'label': 'IPFcolor_[{} {} {}]'.format(*m),
'meta' : {
'Unit': 'RGB (8bit)',
'Lattice': lattice,
'Description': 'Inverse Pole Figure (IPF) colors for direction/plane [{} {} {})'.format(*m),
'Creator': 'dadf5.py:add_IPFcolor v{}'.format(version)
}
@staticmethod
def _add_maximum_shear(S):
return {
'data': mechanics.maximum_shear(S['data']),
'label': 'max_shear({})'.format(S['label']),
'meta': {
'Unit': S['meta']['Unit'],
'Description': 'Maximum shear component of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_maximum_shear v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_IPFcolor,{'q':q},{'l':l})
def add_maximum_shear(self,S):
"""
Add maximum shear components of symmetric tensor.
@ -695,21 +697,23 @@ class DADF5():
Label of symmetric tensor dataset.
"""
def _add_maximum_shear(S):
return {
'data': mechanics.maximum_shear(S['data']),
'label': 'max_shear({})'.format(S['label']),
'meta': {
'Unit': S['meta']['Unit'],
'Description': 'Maximum shear component of {} ({})'.format(S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_maximum_shear v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_maximum_shear,{'S':S})
self._add_generic_pointwise(self._add_maximum_shear,{'S':S})
@staticmethod
def _add_Mises(S):
t = 'strain' if S['meta']['Unit'] == '1' else \
'stress'
return {
'data': mechanics.Mises_strain(S['data']) if t=='strain' else mechanics.Mises_stress(S['data']),
'label': '{}_vM'.format(S['label']),
'meta': {
'Unit': S['meta']['Unit'],
'Description': 'Mises equivalent {} of {} ({})'.format(t,S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_Mises v{}'.format(version)
}
}
def add_Mises(self,S):
"""
Add the equivalent Mises stress or strain of a symmetric tensor.
@ -720,23 +724,32 @@ class DADF5():
Label of symmetric tensorial stress or strain dataset.
"""
def _add_Mises(S):
t = 'strain' if S['meta']['Unit'] == '1' else \
'stress'
return {
'data': mechanics.Mises_strain(S['data']) if t=='strain' else mechanics.Mises_stress(S['data']),
'label': '{}_vM'.format(S['label']),
'meta': {
'Unit': S['meta']['Unit'],
'Description': 'Mises equivalent {} of {} ({})'.format(t,S['label'],S['meta']['Description']),
'Creator': 'dadf5.py:add_Mises v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_Mises,{'S':S})
self._add_generic_pointwise(self._add_Mises,{'S':S})
@staticmethod
def _add_norm(x,ord):
o = ord
if len(x['data'].shape) == 2:
axis = 1
t = 'vector'
if o is None: o = 2
elif len(x['data'].shape) == 3:
axis = (1,2)
t = 'tensor'
if o is None: o = 'fro'
else:
raise ValueError
return {
'data': np.linalg.norm(x['data'],ord=o,axis=axis,keepdims=True),
'label': '|{}|_{}'.format(x['label'],o),
'meta': {
'Unit': x['meta']['Unit'],
'Description': '{}-norm of {} {} ({})'.format(o,t,x['label'],x['meta']['Description']),
'Creator': 'dadf5.py:add_norm v{}'.format(version)
}
}
def add_norm(self,x,ord=None):
"""
Add the norm of vector or tensor.
@ -749,36 +762,25 @@ class DADF5():
Order of the norm. inf means NumPys inf object. For details refer to numpy.linalg.norm.
"""
def _add_norm(x,ord):
o = ord
if len(x['data'].shape) == 2:
axis = 1
t = 'vector'
if o is None: o = 2
elif len(x['data'].shape) == 3:
axis = (1,2)
t = 'tensor'
if o is None: o = 'fro'
else:
raise ValueError
return {
'data': np.linalg.norm(x['data'],ord=o,axis=axis,keepdims=True),
'label': '|{}|_{}'.format(x['label'],o),
'meta': {
'Unit': x['meta']['Unit'],
'Description': '{}-norm of {} {} ({})'.format(ord,t,x['label'],x['meta']['Description']),
'Creator': 'dadf5.py:add_norm v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_norm,{'x':x},{'ord':ord})
self._add_generic_pointwise(self._add_norm,{'x':x},{'ord':ord})
@staticmethod
def _add_PK2(P,F):
return {
'data': mechanics.PK2(P['data'],F['data']),
'label': 'S',
'meta': {
'Unit': P['meta']['Unit'],
'Description': '2. Kirchhoff stress calculated from {} ({}) '.format(P['label'],
P['meta']['Description'])+\
'and {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_PK2 v{}'.format(version)
}
}
def add_PK2(self,P='P',F='F'):
"""
Add 2. Piola-Kirchhoff calculated from first Piola-Kirchhoff stress and deformation gradient.
Add second Piola-Kirchhoff calculated from first Piola-Kirchhoff stress and deformation gradient.
Parameters
----------
@ -788,23 +790,32 @@ class DADF5():
Label of deformation gradient dataset. Defaults to F.
"""
def _add_PK2(P,F):
return {
'data': mechanics.PK2(P['data'],F['data']),
'label': 'S',
'meta': {
'Unit': P['meta']['Unit'],
'Description': '2. Kirchhoff stress calculated from {} ({}) '.format(P['label'],
P['meta']['Description'])+\
'and {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_PK2 v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_PK2,{'P':P,'F':F})
self._add_generic_pointwise(self._add_PK2,{'P':P,'F':F})
@staticmethod
def _add_pole(q,p,polar):
pole = np.array(p)
unit_pole = pole/np.linalg.norm(pole)
m = util.scale_to_coprime(pole)
coords = np.empty((len(q['data']),2))
for i,q in enumerate(q['data']):
o = Rotation(np.array([q['w'],q['x'],q['y'],q['z']]))
rotatedPole = o*unit_pole # rotate pole according to crystal orientation
(x,y) = rotatedPole[0:2]/(1.+abs(unit_pole[2])) # stereographic projection
coords[i] = [np.sqrt(x*x+y*y),np.arctan2(y,x)] if polar else [x,y]
return {
'data': coords,
'label': 'p^{}_[{} {} {})'.format(u'' if polar else 'xy',*m),
'meta' : {
'Unit': '1',
'Description': '{} coordinates of stereographic projection of pole (direction/plane) in crystal frame'\
.format('Polar' if polar else 'Cartesian'),
'Creator' : 'dadf5.py:add_pole v{}'.format(version)
}
}
def add_pole(self,q,p,polar=False):
"""
Add coordinates of stereographic projection of given pole in crystal frame.
@ -819,33 +830,22 @@ class DADF5():
Give pole in polar coordinates. Defaults to False.
"""
def _add_pole(q,p,polar):
self._add_generic_pointwise(self._add_pole,{'q':q},{'p':p,'polar':polar})
pole = np.array(p)
unit_pole = pole/np.linalg.norm(pole)
m = util.scale_to_coprime(pole)
coords = np.empty((len(q['data']),2))
for i,q in enumerate(q['data']):
o = Rotation(np.array([q['w'],q['x'],q['y'],q['z']]))
rotatedPole = o*unit_pole # rotate pole according to crystal orientation
(x,y) = rotatedPole[0:2]/(1.+abs(unit_pole[2])) # stereographic projection
coords[i] = [np.sqrt(x*x+y*y),np.arctan2(y,x)] if polar else [x,y]
return {
'data': coords,
'label': 'p^{}_[{} {} {})'.format(u'' if polar else 'xy',*m),
'meta' : {
'Unit': '1',
'Description': '{} coordinates of stereographic projection of pole (direction/plane) in crystal frame'\
.format('Polar' if polar else 'Cartesian'),
'Creator' : 'dadf5.py:add_pole v{}'.format(version)
}
@staticmethod
def _add_rotational_part(F):
if not F['data'].shape[1:] == (3,3):
raise ValueError
return {
'data': mechanics.rotational_part(F['data']),
'label': 'R({})'.format(F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': 'Rotational part of {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_rotational_part v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_pole,{'q':q},{'p':p,'polar':polar})
def add_rotational_part(self,F):
"""
Add rotational part of a deformation gradient.
@ -856,21 +856,23 @@ class DADF5():
Label of deformation gradient dataset.
"""
def _add_rotational_part(F):
return {
'data': mechanics.rotational_part(F['data']),
'label': 'R({})'.format(F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': 'Rotational part of {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_rotational_part v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_rotational_part,{'F':F})
self._add_generic_pointwise(self._add_rotational_part,{'F':F})
@staticmethod
def _add_spherical(T):
if not T['data'].shape[1:] == (3,3):
raise ValueError
return {
'data': mechanics.spherical_part(T['data']),
'label': 'p_{}'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Spherical component of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_spherical v{}'.format(version)
}
}
def add_spherical(self,T):
"""
Add the spherical (hydrostatic) part of a tensor.
@ -881,24 +883,23 @@ class DADF5():
Label of tensor dataset.
"""
def _add_spherical(T):
self._add_generic_pointwise(self._add_spherical,{'T':T})
if not np.all(np.array(T['data'].shape[1:]) == np.array([3,3])):
@staticmethod
def _add_strain_tensor(F,t,m):
if not F['data'].shape[1:] == (3,3):
raise ValueError
return {
'data': mechanics.spherical_part(T['data']),
'label': 'p_{}'.format(T['label']),
'meta': {
'Unit': T['meta']['Unit'],
'Description': 'Spherical component of tensor {} ({})'.format(T['label'],T['meta']['Description']),
'Creator': 'dadf5.py:add_spherical v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_spherical,{'T':T})
return {
'data': mechanics.strain_tensor(F['data'],t,m),
'label': 'epsilon_{}^{}({})'.format(t,m,F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': 'Strain tensor of {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_strain_tensor v{}'.format(version)
}
}
def add_strain_tensor(self,F='F',t='V',m=0.0):
"""
Add strain tensor of a deformation gradient.
@ -916,21 +917,24 @@ class DADF5():
Order of the strain calculation. Defaults to 0.0.
"""
def _add_strain_tensor(F,t,m):
return {
'data': mechanics.strain_tensor(F['data'],t,m),
'label': 'epsilon_{}^{}({})'.format(t,m,F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': 'Strain tensor of {} ({})'.format(F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_strain_tensor v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_strain_tensor,{'F':F},{'t':t,'m':m})
self._add_generic_pointwise(self._add_strain_tensor,{'F':F},{'t':t,'m':m})
@staticmethod
def _add_stretch_tensor(F,t):
if not F['data'].shape[1:] == (3,3):
raise ValueError
return {
'data': mechanics.left_stretch(F['data']) if t == 'V' else mechanics.right_stretch(F['data']),
'label': '{}({})'.format(t,F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': '{} stretch tensor of {} ({})'.format('Left' if t == 'V' else 'Right',
F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_stretch_tensor v{}'.format(version)
}
}
def add_stretch_tensor(self,F='F',t='V'):
"""
Add stretch tensor of a deformation gradient.
@ -944,77 +948,65 @@ class DADF5():
Defaults to V.
"""
def _add_stretch_tensor(F,t):
return {
'data': mechanics.left_stretch(F['data']) if t == 'V' else mechanics.right_stretch(F['data']),
'label': '{}({})'.format(t,F['label']),
'meta': {
'Unit': F['meta']['Unit'],
'Description': '{} stretch tensor of {} ({})'.format('Left' if t == 'V' else 'Right',
F['label'],F['meta']['Description']),
'Creator': 'dadf5.py:add_stretch_tensor v{}'.format(version)
}
}
self.__add_generic_pointwise(_add_stretch_tensor,{'F':F},{'t':t})
self._add_generic_pointwise(self._add_stretch_tensor,{'F':F},{'t':t})
def __add_generic_pointwise(self,func,dataset_mapping,args={}):
def _job(self,group,func,datasets,args,lock):
"""Execute job for _add_generic_pointwise."""
try:
datasets_in = {}
lock.acquire()
with h5py.File(self.fname,'r') as f:
for arg,label in datasets.items():
loc = f[group+'/'+label]
datasets_in[arg]={'data' :loc[()],
'label':label,
'meta': {k:v.decode() for k,v in loc.attrs.items()}}
lock.release()
r = func(**datasets_in,**args)
return [group,r]
except Exception as err:
print('Error during calculation: {}.'.format(err))
return None
def _add_generic_pointwise(self,func,datasets,args={}):
"""
General function to add pointwise data.
Parameters
----------
func : function
Function that calculates a new dataset from one or more datasets per HDF5 group.
dataset_mapping : dictionary
Mapping HDF5 data label to callback function argument
extra_args : dictionary, optional
Any extra arguments parsed to func.
Callback function that calculates a new dataset from one or more datasets per HDF5 group.
datasets : dictionary
Details of the datasets to be used: label (in HDF5 file) and arg (argument to which the data is parsed in func).
args : dictionary, optional
Arguments parsed to func.
"""
def job(args):
"""Call function with input data + extra arguments, returns results + group."""
args['results'].put({**args['func'](**args['in']),'group':args['group']})
N_threads = int(Environment().options['DAMASK_NUM_THREADS'])
pool = multiprocessing.Pool(N_threads)
lock = multiprocessing.Manager().Lock()
env = Environment()
N_threads = int(env.options['DAMASK_NUM_THREADS'])
N_threads //=N_threads # disable for the moment
groups = self.groups_with_datasets(datasets.values())
default_arg = partial(self._job,func=func,datasets=datasets,args=args,lock=lock)
results = Queue(N_threads)
pool = util.ThreadPool(N_threads)
N_added = N_threads + 1
util.progressBar(iteration=0,total=len(groups))
for i,result in enumerate(pool.imap_unordered(default_arg,groups)):
util.progressBar(iteration=i+1,total=len(groups))
if not result: continue
lock.acquire()
with h5py.File(self.fname, 'a') as f:
try:
dataset = f[result[0]].create_dataset(result[1]['label'],data=result[1]['data'])
for l,v in result[1]['meta'].items():
dataset.attrs[l]=v.encode()
except OSError as err:
print('Could not add dataset: {}.'.format(err))
lock.release()
todo = []
# ToDo: It would be more memory efficient to read only from file when required, i.e. do to it in pool.add_task
for group in self.groups_with_datasets(dataset_mapping.values()):
with h5py.File(self.fname,'r') as f:
datasets_in = {}
for arg,label in dataset_mapping.items():
loc = f[group+'/'+label]
data = loc[()]
meta = {k:loc.attrs[k].decode() for k in loc.attrs.keys()}
datasets_in[arg] = {'data': data, 'meta': meta, 'label': label}
todo.append({'in':{**datasets_in,**args},'func':func,'group':group,'results':results})
pool.map(job, todo[:N_added]) # initialize
N_not_calculated = len(todo)
while N_not_calculated > 0:
result = results.get()
with h5py.File(self.fname,'a') as f: # write to file
dataset_out = f[result['group']].create_dataset(result['label'],data=result['data'])
for k in result['meta'].keys():
dataset_out.attrs[k] = result['meta'][k].encode()
N_not_calculated-=1
if N_added < len(todo): # add more jobs
pool.add_task(job,todo[N_added])
N_added +=1
pool.wait_completion()
pool.close()
pool.join()
def to_vtk(self,labels,mode='cell'):
@ -1098,29 +1090,27 @@ class DADF5():
for label in (labels if isinstance(labels,list) else [labels]):
for p in self.iter_visible('con_physics'):
if p != 'generic':
for c in self.iter_visible('constituents'):
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),
deep=True,array_type= vtk.VTK_DOUBLE))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1]) #ToDo: hard coded 1!
vtk_geom.GetCellData().AddArray(vtk_data[-1])
for c in self.iter_visible('constituents'):
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),deep=True))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1]) #ToDo: hard coded 1!
vtk_geom.GetCellData().AddArray(vtk_data[-1])
else:
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),
deep=True,array_type= vtk.VTK_DOUBLE))
ph_name = re.compile(r'(?<=(constituent\/))(.*?)(?=(generic))') # identify phase name
dset_name = '1_' + re.sub(ph_name,r'',x[0].split('/',1)[1]) # removing phase name
vtk_data[-1].SetName(dset_name)
vtk_geom.GetCellData().AddArray(vtk_data[-1])
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),deep=True))
ph_name = re.compile(r'(?<=(constituent\/))(.*?)(?=(generic))') # identify phase name
dset_name = '1_' + re.sub(ph_name,r'',x[0].split('/',1)[1]) # removing phase name
vtk_data[-1].SetName(dset_name)
vtk_geom.GetCellData().AddArray(vtk_data[-1])
self.set_visible('materialpoints',materialpoints_backup)
@ -1129,38 +1119,35 @@ class DADF5():
for label in (labels if isinstance(labels,list) else [labels]):
for p in self.iter_visible('mat_physics'):
if p != 'generic':
for m in self.iter_visible('materialpoints'):
for m in self.iter_visible('materialpoints'):
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),deep=True))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1]) #ToDo: why 1_?
vtk_geom.GetCellData().AddArray(vtk_data[-1])
else:
x = self.get_dataset_location(label)
if len(x) == 0:
continue
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),
deep=True,array_type= vtk.VTK_DOUBLE))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1]) #ToDo: why 1_?
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),deep=True))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1])
vtk_geom.GetCellData().AddArray(vtk_data[-1])
else:
x = self.get_dataset_location(label)
if len(x) == 0:
continue
array = self.read_dataset(x,0)
shape = [array.shape[0],np.product(array.shape[1:])]
vtk_data.append(numpy_support.numpy_to_vtk(num_array=array.reshape(shape),
deep=True,array_type= vtk.VTK_DOUBLE))
vtk_data[-1].SetName('1_'+x[0].split('/',1)[1])
vtk_geom.GetCellData().AddArray(vtk_data[-1])
self.set_visible('constituents',constituents_backup)
if mode.lower()=='cell':
writer = vtk.vtkXMLRectilinearGridWriter() if self.structured else \
vtk.vtkXMLUnstructuredGridWriter()
x = self.get_dataset_location('u_n')
vtk_data.append(numpy_support.numpy_to_vtk(num_array=self.read_dataset(x,0),
deep=True,array_type=vtk.VTK_DOUBLE))
vtk_data[-1].SetName('u')
vtk_geom.GetPointData().AddArray(vtk_data[-1])
writer = vtk.vtkXMLRectilinearGridWriter() if self.structured else \
vtk.vtkXMLUnstructuredGridWriter()
x = self.get_dataset_location('u_n')
vtk_data.append(numpy_support.numpy_to_vtk(num_array=self.read_dataset(x,0),deep=True))
vtk_data[-1].SetName('u')
vtk_geom.GetPointData().AddArray(vtk_data[-1])
elif mode.lower()=='point':
writer = vtk.vtkXMLPolyDataWriter()
writer = vtk.vtkXMLPolyDataWriter()
file_out = '{}_inc{}.{}'.format(os.path.splitext(os.path.basename(self.fname))[0],

View File

@ -6,8 +6,6 @@ import shlex
from fractions import Fraction
from functools import reduce
from optparse import Option
from queue import Queue
from threading import Thread
import numpy as np
@ -201,57 +199,3 @@ class return_message():
def __repr__(self):
"""Return message suitable for interactive shells."""
return srepr(self.message)
class ThreadPool:
"""Pool of threads consuming tasks from a queue."""
class Worker(Thread):
"""Thread executing tasks from a given tasks queue."""
def __init__(self, tasks):
"""Worker for tasks."""
Thread.__init__(self)
self.tasks = tasks
self.daemon = True
self.start()
def run(self):
while True:
func, args, kargs = self.tasks.get()
try:
func(*args, **kargs)
except Exception as e:
# An exception happened in this thread
print(e)
finally:
# Mark this task as done, whether an exception happened or not
self.tasks.task_done()
def __init__(self, num_threads):
"""
Thread pool.
Parameters
----------
num_threads : int
number of threads
"""
self.tasks = Queue(num_threads)
for _ in range(num_threads):
self.Worker(self.tasks)
def add_task(self, func, *args, **kargs):
"""Add a task to the queue."""
self.tasks.put((func, args, kargs))
def map(self, func, args_list):
"""Add a list of tasks to the queue."""
for args in args_list:
self.add_task(func, args)
def wait_completion(self):
"""Wait for completion of all the tasks in the queue."""
self.tasks.join()