import os from itertools import permutations import pytest import numpy as np from damask import Table from damask import Rotation from damask import Orientation from damask import Lattice n = 1000 def IPF_color(orientation,direction): """TSL color of inverse pole figure for given axis (non-vectorized).""" for o in orientation.equivalent: pole = o.rotation@direction inSST,color = orientation.lattice.in_SST(pole,color=True) if inSST: break return color def inverse_pole(orientation,axis,proper=False,SST=True): if SST: for eq in orientation.equivalent: pole = eq.rotation @ axis/np.linalg.norm(axis) if orientation.lattice.in_SST(pole,proper=proper): return pole else: return orientation.rotation @ axis/np.linalg.norm(axis) @pytest.fixture def reference_dir(reference_dir_base): """Directory containing reference results.""" return reference_dir_base/'Rotation' class TestOrientation: @pytest.mark.parametrize('model',['Bain','KS','GT','GT_prime','NW','Pitsch']) @pytest.mark.parametrize('lattice',['fcc','bcc']) def test_relationship_vectorize(self,set_of_quaternions,lattice,model): result = Orientation(set_of_quaternions[:200].reshape(50,4,4),lattice).related(model) ref_qu = result.rotation.quaternion.reshape(-1,200,4) for i in range(200): single = Orientation(set_of_quaternions[i],lattice).related(model).rotation.quaternion assert np.allclose(ref_qu[:,i,:],single) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_IPF_vectorize(self,set_of_quaternions,lattice): direction = np.random.random(3)*2.0-1 oris = Orientation(Rotation(set_of_quaternions),lattice)[:200] for i,color in enumerate(oris.IPF_color(direction)): assert np.allclose(color,IPF_color(oris[i],direction)) @pytest.mark.parametrize('SST',[False,True]) @pytest.mark.parametrize('proper',[True,False]) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_inverse_pole_vectorize(self,set_of_quaternions,lattice,SST,proper): axis = np.random.random(3)*2.0-1 oris = Orientation(Rotation(set_of_quaternions),lattice)[:200] for i,pole in enumerate(oris.inverse_pole(axis,SST=SST)): assert np.allclose(pole,inverse_pole(oris[i],axis,SST=SST)) @pytest.mark.parametrize('color',[{'label':'red', 'RGB':[1,0,0],'direction':[0,0,1]}, {'label':'green','RGB':[0,1,0],'direction':[0,1,1]}, {'label':'blue', 'RGB':[0,0,1],'direction':[1,1,1]}]) @pytest.mark.parametrize('lattice',['fcc','bcc']) def test_IPF_cubic(self,color,lattice): cube = Orientation(Rotation(),lattice) for direction in set(permutations(np.array(color['direction']))): assert np.allclose(cube.IPF_color(np.array(direction)),np.array(color['RGB'])) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_IPF_equivalent(self,set_of_quaternions,lattice): direction = np.random.random(3)*2.0-1 for ori in Orientation(Rotation(set_of_quaternions),lattice)[:200]: color = ori.IPF_color(direction) for equivalent in ori.equivalent: assert np.allclose(color,equivalent.IPF_color(direction)) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_reduced(self,set_of_quaternions,lattice): oris = Orientation(Rotation(set_of_quaternions),lattice) reduced = oris.reduced assert np.all(reduced.in_FZ) and oris.rotation.shape == reduced.rotation.shape @pytest.mark.parametrize('model',['Bain','KS','GT','GT_prime','NW','Pitsch']) @pytest.mark.parametrize('lattice',['fcc','bcc']) def test_relationship_forward_backward(self,model,lattice): ori = Orientation(Rotation.from_random(),lattice) for i,r in enumerate(ori.related(model)): ori2 = r.related(model)[i] misorientation = ori.rotation.misorientation(ori2.rotation) assert misorientation.as_axis_angle(degrees=True)[3]<1.0e-5 @pytest.mark.parametrize('model',['Bain','KS','GT','GT_prime','NW','Pitsch']) @pytest.mark.parametrize('lattice',['fcc','bcc']) def test_relationship_reference(self,update,reference_dir,model,lattice): reference = os.path.join(reference_dir,f'{lattice}_{model}.txt') ori = Orientation(Rotation(),lattice) eu = np.array([o.rotation.as_Eulers(degrees=True) for o in ori.related(model)]) if update: coords = np.array([(1,i+1) for i,x in enumerate(eu)]) table = Table(eu,{'Eulers':(3,)}) table = table.add('pos',coords) table.save(reference) assert np.allclose(eu,Table.load(reference).get('Eulers')) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_disorientation360(self,lattice): R_1 = Orientation(Rotation(),lattice) R_2 = Orientation(Rotation.from_Eulers([360,0,0],degrees=True),lattice) assert np.allclose(R_1.disorientation(R_2).as_matrix(),np.eye(3)) @pytest.mark.parametrize('lattice',Lattice.lattices) @pytest.mark.parametrize('angle',[10,20,30,40]) def test_average(self,angle,lattice): R_1 = Orientation(Rotation.from_axis_angle([0,0,1,10],degrees=True),lattice) R_2 = Orientation(Rotation.from_axis_angle([0,0,1,angle],degrees=True),lattice) avg_angle = R_1.average(R_2).rotation.as_axis_angle(degrees=True,pair=True)[1] assert np.isclose(avg_angle,10+(angle-10)/2.) @pytest.mark.parametrize('lattice',Lattice.lattices) def test_from_average(self,lattice): R_1 = Orientation(Rotation.from_random(),lattice) eqs = [r for r in R_1.equivalent] R_2 = Orientation.from_average(eqs) assert np.allclose(R_1.rotation.quaternion,R_2.rotation.quaternion)