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#705 fix sign error #706

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Nov 6, 2019
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1 change: 1 addition & 0 deletions CHANGELOG.md
Original file line number Diff line number Diff line change
Expand Up @@ -21,6 +21,7 @@

## Bug fixes

- Correct a sign error in Dirichlet boundary conditions in the Finite Element Method ([#706](https://github.com/pybamm-team/PyBaMM/pull/706))
- Pass the correct dimensional temperature to open circuit potential ([#702](https://github.com/pybamm-team/PyBaMM/pull/702))
- Adds missing temperature dependence in electrolyte and interface submodels ([#698](https://github.com/pybamm-team/PyBaMM/pull/698))
- Fix differentiation of functions that have more than one argument ([#687](https://github.com/pybamm-team/PyBaMM/pull/687))
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8 changes: 4 additions & 4 deletions pybamm/spatial_methods/scikit_finite_element.py
Original file line number Diff line number Diff line change
Expand Up @@ -51,11 +51,11 @@ def spatial_variable(self, symbol):
symbol_mesh = self.mesh
if symbol.name == "y":
vector = pybamm.Vector(
symbol_mesh["current collector"][0].edges["y"], domain=symbol.domain
symbol_mesh["current collector"][0].coordinates[0, :][:, np.newaxis]
)
elif symbol.name == "z":
vector = pybamm.Vector(
symbol_mesh["current collector"][0].edges["z"], domain=symbol.domain
symbol_mesh["current collector"][0].coordinates[1, :][:, np.newaxis]
)
else:
raise pybamm.GeometryError(
Expand Down Expand Up @@ -121,7 +121,7 @@ def unit_bc_load_form(v, dv, w):
# set Dirichlet value at facets corresponding to tab
neg_bc_load = np.zeros(mesh.npts)
neg_bc_load[mesh.negative_tab_dofs] = 1
boundary_load = boundary_load - neg_bc_value * pybamm.Vector(neg_bc_load)
boundary_load = boundary_load + neg_bc_value * pybamm.Vector(neg_bc_load)
else:
raise ValueError(
"boundary condition must be Dirichlet or Neumann, not '{}'".format(
Expand All @@ -138,7 +138,7 @@ def unit_bc_load_form(v, dv, w):
# set Dirichlet value at facets corresponding to tab
pos_bc_load = np.zeros(mesh.npts)
pos_bc_load[mesh.positive_tab_dofs] = 1
boundary_load = boundary_load - pos_bc_value * pybamm.Vector(pos_bc_load)
boundary_load = boundary_load + pos_bc_value * pybamm.Vector(pos_bc_load)
else:
raise ValueError(
"boundary condition must be Dirichlet or Neumann, not '{}'".format(
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28 changes: 10 additions & 18 deletions tests/unit/test_processed_variable.py
Original file line number Diff line number Diff line change
Expand Up @@ -140,39 +140,35 @@ def test_processed_variable_3D_x_z(self):

def test_processed_variable_3D_scikit(self):
var = pybamm.Variable("var", domain=["current collector"])
y = pybamm.SpatialVariable("y", domain=["current collector"])
z = pybamm.SpatialVariable("z", domain=["current collector"])

disc = tests.get_2p1d_discretisation_for_testing()
disc.set_variable_slices([var])
y_sol = disc.process_symbol(y).entries[:, 0]
z_sol = disc.process_symbol(z).entries[:, 0]
y = disc.mesh["current collector"][0].edges["y"]
z = disc.mesh["current collector"][0].edges["z"]
var_sol = disc.process_symbol(var)
t_sol = np.linspace(0, 1)
u_sol = np.ones(var_sol.shape[0])[:, np.newaxis] * np.linspace(0, 5)

processed_var = pybamm.ProcessedVariable(var_sol, t_sol, u_sol, mesh=disc.mesh)
np.testing.assert_array_equal(
processed_var.entries,
np.reshape(u_sol, [len(y_sol), len(z_sol), len(t_sol)]),
np.reshape(u_sol, [len(y), len(z), len(t_sol)]),
)

def test_processed_variable_2Dspace_scikit(self):
var = pybamm.Variable("var", domain=["current collector"])
y = pybamm.SpatialVariable("y", domain=["current collector"])
z = pybamm.SpatialVariable("z", domain=["current collector"])

disc = tests.get_2p1d_discretisation_for_testing()
disc.set_variable_slices([var])
y_sol = disc.process_symbol(y).entries[:, 0]
z_sol = disc.process_symbol(z).entries[:, 0]
y = disc.mesh["current collector"][0].edges["y"]
z = disc.mesh["current collector"][0].edges["z"]
var_sol = disc.process_symbol(var)
t_sol = np.array([0])
u_sol = np.ones(var_sol.shape[0])[:, np.newaxis]

processed_var = pybamm.ProcessedVariable(var_sol, t_sol, u_sol, mesh=disc.mesh)
np.testing.assert_array_equal(
processed_var.entries, np.reshape(u_sol, [len(y_sol), len(z_sol)])
processed_var.entries, np.reshape(u_sol, [len(y), len(z)])
)

def test_processed_var_1D_interpolation(self):
Expand Down Expand Up @@ -367,13 +363,11 @@ def test_processed_var_3D_r_first_dimension(self):

def test_processed_var_3D_scikit_interpolation(self):
var = pybamm.Variable("var", domain=["current collector"])
y = pybamm.SpatialVariable("y", domain=["current collector"])
z = pybamm.SpatialVariable("z", domain=["current collector"])

disc = tests.get_2p1d_discretisation_for_testing()
disc.set_variable_slices([var])
y_sol = disc.process_symbol(y).entries[:, 0]
z_sol = disc.process_symbol(z).entries[:, 0]
y_sol = disc.mesh["current collector"][0].edges["y"]
z_sol = disc.mesh["current collector"][0].edges["z"]
var_sol = disc.process_symbol(var)
t_sol = np.linspace(0, 1)
u_sol = np.ones(var_sol.shape[0])[:, np.newaxis] * np.linspace(0, 5)
Expand Down Expand Up @@ -406,13 +400,11 @@ def test_processed_var_3D_scikit_interpolation(self):

def test_processed_var_2Dspace_scikit_interpolation(self):
var = pybamm.Variable("var", domain=["current collector"])
y = pybamm.SpatialVariable("y", domain=["current collector"])
z = pybamm.SpatialVariable("z", domain=["current collector"])

disc = tests.get_2p1d_discretisation_for_testing()
disc.set_variable_slices([var])
y_sol = disc.process_symbol(y).entries[:, 0]
z_sol = disc.process_symbol(z).entries[:, 0]
y_sol = disc.mesh["current collector"][0].edges["y"]
z_sol = disc.mesh["current collector"][0].edges["z"]
var_sol = disc.process_symbol(var)
t_sol = np.array([0])
u_sol = np.ones(var_sol.shape[0])[:, np.newaxis]
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62 changes: 62 additions & 0 deletions tests/unit/test_spatial_methods/test_scikit_finite_element.py
Original file line number Diff line number Diff line change
Expand Up @@ -461,6 +461,68 @@ def test_pure_neumann_poisson(self):
u_exact = z ** 2 / 2 - 1 / 6
np.testing.assert_array_almost_equal(solution.y[:-1], u_exact, decimal=1)

def test_dirichlet_bcs(self):
# manufactured solution u = a*z^2 + b*z + c
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model = pybamm.BaseModel()
a = 3
b = 4
c = 5
u = pybamm.Variable("variable", domain="current collector")
model.algebraic = {u: -pybamm.laplacian(u) + pybamm.source(2 * a, u)}
# set boundary conditions ("negative tab" = bottom of unit square,
# "positive tab" = top of unit square, elsewhere normal derivative is zero)
model.boundary_conditions = {
u: {
"negative tab": (pybamm.Scalar(c), "Dirichlet"),
"positive tab": (pybamm.Scalar(a + b + c), "Dirichlet"),
}
}
# bad initial guess (on purpose)
model.initial_conditions = {u: pybamm.Scalar(1)}
model.variables = {"u": u}
# create discretisation
mesh = get_unit_2p1D_mesh_for_testing(ypts=8, zpts=32)
spatial_methods = {
"macroscale": pybamm.FiniteVolume,
"current collector": pybamm.ScikitFiniteElement,
}
disc = pybamm.Discretisation(mesh, spatial_methods)
disc.process_model(model)

# solve model
solver = pybamm.AlgebraicSolver()
solution = solver.solve(model)

# indepedent of y, so just check values for one y
z = mesh["current collector"][0].edges["z"][:, np.newaxis]
u_exact = a * z ** 2 + b * z + c
np.testing.assert_array_almost_equal(solution.y[0 : len(z)], u_exact)

def test_disc_spatial_var(self):
mesh = get_unit_2p1D_mesh_for_testing(ypts=4, zpts=5)
spatial_methods = {
"macroscale": pybamm.FiniteVolume,
"current collector": pybamm.ScikitFiniteElement,
}
disc = pybamm.Discretisation(mesh, spatial_methods)

# discretise y and z
y = pybamm.SpatialVariable("y", ["current collector"])
z = pybamm.SpatialVariable("z", ["current collector"])
y_disc = disc.process_symbol(y)
z_disc = disc.process_symbol(z)

# create expected meshgrid
y_vec = np.linspace(0, 1, 4)
z_vec = np.linspace(0, 1, 5)
Y, Z = np.meshgrid(y_vec, z_vec)
y_actual = np.transpose(Y).flatten()[:, np.newaxis]
z_actual = np.transpose(Z).flatten()[:, np.newaxis]

# spatial vars should discretise to the flattend meshgrid
np.testing.assert_array_equal(y_disc.evaluate(), y_actual)
np.testing.assert_array_equal(z_disc.evaluate(), z_actual)


if __name__ == "__main__":
print("Add -v for more debug output")
Expand Down