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essolve.py
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essolve.py
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# This file is part of QuTiP: Quantum Toolbox in Python.
#
# Copyright (c) 2011 and later, Paul D. Nation and Robert J. Johansson.
# All rights reserved.
#
# Redistribution and use in source and binary forms, with or without
# modification, are permitted provided that the following conditions are
# met:
#
# 1. Redistributions of source code must retain the above copyright notice,
# this list of conditions and the following disclaimer.
#
# 2. Redistributions in binary form must reproduce the above copyright
# notice, this list of conditions and the following disclaimer in the
# documentation and/or other materials provided with the distribution.
#
# 3. Neither the name of the QuTiP: Quantum Toolbox in Python nor the names
# of its contributors may be used to endorse or promote products derived
# from this software without specific prior written permission.
#
# THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS
# "AS IS" AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT
# LIMITED TO, THE IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A
# PARTICULAR PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT
# HOLDER OR CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL,
# SPECIAL, EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT
# LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE,
# DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY
# THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT
# (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
# OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
###############################################################################
import numpy as np
from qutip.qobj import Qobj
from qutip.eseries import eseries, estidy, esval
from qutip.expect import expect
from qutip.superoperator import *
from qutip.odedata import Odedata
# -----------------------------------------------------------------------------
# pass on to wavefunction solver or master equation solver depending on whether
# any collapse operators were given.
#
def essolve(H, rho0, tlist, c_op_list, e_ops):
"""
Evolution of a state vector or density matrix (`rho0`) for a given
Hamiltonian (`H`) and set of collapse operators (`c_op_list`), by
expressing the ODE as an exponential series. The output is either
the state vector at arbitrary points in time (`tlist`), or the
expectation values of the supplied operators (`e_ops`).
Parameters
----------
H : qobj/function_type
System Hamiltonian.
rho0 : :class:`qutip.qobj`
Initial state density matrix.
tlist : list/array
``list`` of times for :math:`t`.
c_op_list : list of :class:`qutip.qobj`
``list`` of :class:`qutip.qobj` collapse operators.
e_ops : list of :class:`qutip.qobj`
``list`` of :class:`qutip.qobj` operators for which to evaluate
expectation values.
Returns
-------
expt_array : array
Expectation values of wavefunctions/density matrices for the
times specified in ``tlist``.
.. note:: This solver does not support time-dependent Hamiltonians.
"""
n_expt_op = len(e_ops)
n_tsteps = len(tlist)
# Calculate the Liouvillian
if (c_op_list is None or len(c_op_list) == 0) and isket(rho0):
L = H
else:
L = liouvillian(H, c_op_list)
es = ode2es(L, rho0)
# evaluate the expectation values
if n_expt_op == 0:
result_list = [Qobj()] * n_tsteps # XXX
else:
result_list = np.zeros([n_expt_op, n_tsteps], dtype=complex)
for n, e in enumerate(e_ops):
result_list[n, :] = expect(e, esval(es, tlist))
data = Odedata()
data.solver = "essolve"
data.times = tlist
data.expect = [np.real(result_list[n, :]) if e.isherm else result_list[n, :]
for n, e in enumerate(e_ops)]
return data
# -----------------------------------------------------------------------------
#
#
def ode2es(L, rho0):
"""Creates an exponential series that describes the time evolution for the
initial density matrix (or state vector) `rho0`, given the Liouvillian
(or Hamiltonian) `L`.
Parameters
----------
L : qobj
Liouvillian of the system.
rho0 : qobj
Initial state vector or density matrix.
Returns
-------
eseries : :class:`qutip.eseries`
``eseries`` represention of the system dynamics.
"""
if issuper(L):
# check initial state
if isket(rho0):
# Got a wave function as initial state: convert to density matrix.
rho0 = rho0 * rho0.dag()
w, v = L.eigenstates()
v = np.hstack([ket.full() for ket in v])
# w[i] = eigenvalue i
# v[:,i] = eigenvector i
rlen = prod(rho0.shape)
r0 = mat2vec(rho0.full())
v0 = la.solve(v, r0)
vv = v * sp.spdiags(v0.T, 0, rlen, rlen)
out = None
for i in range(rlen):
qo = Qobj(vec2mat(vv[:, i]), dims=rho0.dims, shape=rho0.shape)
if out:
out += eseries(qo, w[i])
else:
out = eseries(qo, w[i])
elif isoper(L):
if not isket(rho0):
raise TypeError('Second argument must be a ket if first' +
'is a Hamiltonian.')
w, v = L.eigenstates()
v = np.hstack([ket.full() for ket in v])
# w[i] = eigenvalue i
# v[:,i] = eigenvector i
rlen = prod(rho0.shape)
r0 = rho0.full()
v0 = la.solve(v, r0)
vv = v * sp.spdiags(v0.T, 0, rlen, rlen)
out = None
for i in range(rlen):
qo = Qobj(np.matrix(vv[:, i]).T, dims=rho0.dims, shape=rho0.shape)
if out:
out += eseries(qo, -1.0j * w[i])
else:
out = eseries(qo, -1.0j * w[i])
else:
raise TypeError('First argument must be a Hamiltonian or Liouvillian.')
return estidy(out)