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Added unit tests for integrator classes
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import openpnm as op | ||
import numpy as np | ||
import numpy.testing as nt | ||
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class IntegratorsTest: | ||
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def setup_class(self): | ||
np.random.seed(10) | ||
self.net = op.network.Cubic([4, 4, 1], spacing=1e-4) | ||
geo_mods = op.models.collections.geometry.spheres_and_cylinders.copy() | ||
self.net.add_model_collection(geo_mods) | ||
self.net.regenerate_models() | ||
self.phase = op.phase.Water(network=self.net) | ||
self.phase['pore.diffusivity'] = 1e-10 | ||
self.phase['pore.concentration'] = 100 | ||
phys_mods = op.models.collections.physics.basic.copy() | ||
self.phase.add_model_collection(phys_mods) | ||
self.phase.regenerate_models() | ||
rxn = op.models.physics.source_terms.standard_kinetics | ||
self.phase['pore.reaction_constant'] = 1e-14 | ||
self.phase['pore.reaction_order'] = 1 | ||
self.phase.add_model(propname='pore.source', | ||
model=rxn, | ||
X='pore.concentration', | ||
prefactor='pore.reaction_constant', | ||
exponent='pore.reaction_order') | ||
self.alg = op.algorithms.TransientReactiveTransport(network=self.net, | ||
phase=self.phase) | ||
self.alg.settings['quantity'] = 'pore.concentration' | ||
self.alg.settings['conductance'] = 'throat.diffusive_conductance' | ||
self.alg.set_source(pores=[0], propname='pore.source', mode='add') | ||
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def test_scipy_RK45(self): | ||
x0 = np.ones(self.net.Np)*100 | ||
tspan = (0, 10) | ||
saveat = 1.0 | ||
integrator = op.integrators.ScipyRK45() | ||
self.alg.run(x0, tspan, saveat, integrator) | ||
x = self.alg.x | ||
nt.assert_allclose(x.mean(), 110.97095388, rtol=1e-5) | ||
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def test_scipy_BDF(self): | ||
x0 = np.ones(self.net.Np)*100 | ||
tspan = (0, 10) | ||
saveat = 1.0 | ||
integrator = op.integrators.ScipyBDF() | ||
self.alg.run(x0, tspan, saveat, integrator) | ||
x = self.alg.x | ||
nt.assert_allclose(x.mean(), 110.97112100, rtol=1e-5) | ||
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def test_scipy_LSODA(self): | ||
x0 = np.ones(self.net.Np)*100 | ||
tspan = (0, 10) | ||
saveat = 1.0 | ||
integrator = op.integrators.ScipyLSODA() | ||
self.alg.run(x0, tspan, saveat, integrator) | ||
x = self.alg.x | ||
nt.assert_allclose(x.mean(), 110.97097456, rtol=1e-5) | ||
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if __name__ == '__main__': | ||
t = IntegratorsTest() | ||
t.setup_class() | ||
self = t | ||
for item in t.__dir__(): | ||
if item.startswith('test'): | ||
print(f'Running test: {item}') | ||
t.__getattribute__(item)() |