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qutip / tests / solver / test_integrator.py
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from qutip.solver.sesolve import SESolver
from qutip.solver.mesolve import MESolver
from qutip.solver.mcsolve import MCSolver
from qutip.solver.solver_base import Solver
from qutip.solver.integrator import *
import qutip
import numpy as np
from numpy.testing import assert_allclose
import pytest

# Deactivate warning for test without cython
from qutip.core.coefficient import WARN_MISSING_MODULE
WARN_MISSING_MODULE[0] = 0


class TestIntegratorCte():
    _analytical_se = lambda _, t: np.cos(t * np.pi)
    se_system = qutip.QobjEvo(-1j * qutip.sigmax() * np.pi)
    _analytical_me = lambda _, t: 1 - np.exp(-t)
    me_system = qutip.liouvillian(qutip.QobjEvo(qutip.qeye(2)),
                                  c_ops=[qutip.destroy(2)])

    @pytest.fixture(params=list(SESolver.avail_integrators().keys()))
    def se_method(self, request):
        return request.param

    @pytest.fixture(params=list(MESolver.avail_integrators().keys()))
    def me_method(self, request):
        return request.param

    # TODO: Change when the MCSolver is added
    @pytest.fixture(params=list(MCSolver.avail_integrators().keys()))
    def mc_method(self, request):
        return request.param

    def test_se_integration(self, se_method):
        evol = SESolver.avail_integrators()[se_method](self.se_system, {})
        state0 = qutip.basis(2, 0).data
        evol.set_state(0, state0)
        for t, state in evol.run(np.linspace(0, 2, 21)):
            assert_allclose(self._analytical_se(t),
                            state.to_array()[0, 0], atol=2e-5)
            assert state.shape == (2, 1)

    def test_me_integration(self, me_method):
        evol = MESolver.avail_integrators()[me_method](self.me_system, {})
        state0 = qutip.operator_to_vector(qutip.fock_dm(2,1)).data
        evol.set_state(0, state0)
        for t in np.linspace(0, 2, 21):
            t_, state = evol.integrate(t)
            assert t_ == t
            assert_allclose(self._analytical_me(t),
                            state.to_array()[0, 0], atol=2e-5)

    def test_mc_integration(self, mc_method):
        evol = MCSolver.avail_integrators()[mc_method](self.se_system, {})
        state = qutip.basis(2,0).data
        evol.set_state(0, state)
        t = 0
        for i in range(1, 21):
            t_target = i * 0.05
            while t < t_target:
                t_old, y_old = evol.get_state()
                t, state = evol.mcstep(t_target)
                assert t <= t_target
                assert t > t_old
                assert_allclose(self._analytical_se(t),
                                state.to_array()[0, 0], atol=2e-5)
                t_back = (t + t_old) / 2
                t_got, bstate = evol.mcstep(t_back)
                assert t_back == t_got
                assert_allclose(self._analytical_se(t),
                                state.to_array()[0, 0], atol=2e-5)
                t, state = evol.mcstep(t)


    @pytest.mark.parametrize('start', [1, -1])
    def test_mc_integration_mixed(self, start, mc_method):
        system = qutip.QobjEvo(qutip.qeye(1))
        evol = Solver.avail_integrators()[mc_method](system, {})

        state = qutip.basis(1,0).data
        evol.set_state(start, state)
        t = start
        t_target = start + .1
        while t < t_target:
            t, _ = evol.mcstep(start + .1)
        _ = evol.mcstep(start + .2)
        t_target = (start + .1 + t) / 2
        t, state = evol.mcstep(t_target)
        assert (
            state.to_array()[0, 0]
            == pytest.approx(np.exp(t - start), abs=1e-5)
        )


class TestIntegrator(TestIntegratorCte):
    _analytical_se = lambda _, t: np.cos(t**2/2 * np.pi)
    se_system = qutip.QobjEvo([-1j * qutip.sigmax() * np.pi, "t"])
    _analytical_me = lambda _, t: 1 - np.exp(-(t**3) / 3)
    me_system = qutip.liouvillian(
        qutip.QobjEvo(qutip.qeye(2)),
        c_ops=[qutip.QobjEvo([qutip.destroy(2), 't'])]
    )

    @pytest.fixture(
        params=[key for key, integrator in SESolver.avail_integrators().items()
                if integrator.support_time_dependant]
    )
    def se_method(self, request):
        return request.param

    @pytest.fixture(
        params=[key for key, integrator in MESolver.avail_integrators().items()
                if integrator.support_time_dependant]
    )
    def me_method(self, request):
        return request.param

    @pytest.fixture(
        params=[key for key, integrator in MCSolver.avail_integrators().items()
                if integrator.support_time_dependant]
    )
    def mc_method(self, request):
        return request.param


@pytest.mark.parametrize('sizes', [(1, 100), (10, 10), (100, 0)],
                     ids=["large", "multiple subspaces", "diagonal"])
def test_krylov(sizes):
    # Krylov solve act differently for large systems composed tensored
    # sub systems.
    N, M = sizes
    H = qutip.qeye(N)
    if M:
        H = H & (qutip.num(M) + qutip.create(M) + qutip.destroy(M))
    H = qutip.QobjEvo(-1j * H)
    integrator = IntegratorKrylov(H, {})
    ref_integrator = IntegratorDiag(H, {})
    psi = qutip.basis(100, 95).data
    integrator.set_state(0, psi)
    ref_integrator.set_state(0, psi)
    for t in np.linspace(0.25, 1, 4):
        out = integrator.integrate(t)[1]
        ref = ref_integrator.integrate(t)[1]
        assert qutip.data.norm.l2(out - ref) == pytest.approx(0, abs=1e-6)


@pytest.mark.parametrize('integrator',
    [IntegratorScipyAdams, IntegratorScipyBDF, IntegratorScipylsoda],
    ids=["adams", 'bdf', "lsoda"]
)
def test_concurent_usage(integrator):
    opt = {'atol':1e-10, 'rtol':1e-7}

    sys1 = qutip.QobjEvo(0.5*qutip.qeye(1))
    inter1 = integrator(sys1, opt)
    inter1.set_state(0, qutip.basis(1,0).data)

    sys2 = qutip.QobjEvo(-0.5*qutip.qeye(1))
    inter2 = integrator(sys2, opt)
    inter2.set_state(0, qutip.basis(1,0).data)

    for t in np.linspace(0,1,6):
        expected1 = pytest.approx(np.exp(t/2), abs=1e-5)
        assert inter1.integrate(t)[1].to_array()[0, 0] == expected1
        expected2 = pytest.approx(np.exp(-t/2), abs=1e-5)
        assert inter2.integrate(t)[1].to_array()[0, 0] == expected2

@pytest.mark.parametrize('integrator',
    [IntegratorVern7, IntegratorVern9],
    ids=["vern7", 'vern9']
)
def test_pickling_vern_methods(integrator):
    """Test whether VernN methods can be pickled and hence used in multiprocessing"""
    opt = {'atol':1e-10, 'rtol':1e-7}

    sys = qutip.QobjEvo(0.5*qutip.qeye(1))
    inter = integrator(sys, opt)
    inter.set_state(0, qutip.basis(1,0).data)

    import pickle
    pickled = pickle.dumps(inter, -1)
    recreated = pickle.loads(pickled)
    recreated.set_state(0, qutip.basis(1,0).data)

    for t in np.linspace(0,1,6):
        expected = pytest.approx(np.exp(t/2), abs=1e-5)
        result1 = inter.integrate(t)[1].to_array()[0, 0]
        result2 = recreated.integrate(t)[1].to_array()[0, 0]
        assert result1 == result2 == expected