time_evolution.md
390 lines · skills/qutip/references/time_evolution.md at 5f2bc03
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QuTiP 5.3 Time Evolution
Research and API verification date: 2026-10-01. All signatures and examples target qutip==5.3.1.
Solver selection
| Solver | State/model | Main uncertainty |
|---|---|---|
sesolve | Schrödinger equation, pure state, no collapse channels | ODE and model approximation |
mesolve | Lindblad master equation, mixed state, or Liouvillian | channel validity and ODE error |
mcsolve | quantum-jump trajectories | ODE error plus sampling error |
brmesolve | microscopic weak-coupling bath spectra | Born-Markov/secular approximation and positivity |
ssesolve | stochastic Schrödinger equation | diffusive record sampling |
smesolve | stochastic master equation with monitored/unmonitored channels | diffusive record sampling |
fsesolve/fmmesolve | periodic Floquet dynamics | period, basis, harmonic and bath approximations |
Do not use mcsolve merely to make a deterministic calculation parallel. Do not use brmesolve as a generic replacement for a Lindblad model.
Current function signatures
The important QuTiP 5.3 call boundaries are:
sesolve(H, psi0, tlist, *, e_ops=None, args=None, options=None)
mesolve(H, rho0, tlist, c_ops=None, *, e_ops=None, args=None, options=None)
mcsolve(H, state, tlist, c_ops=(), *, e_ops=None, ntraj=500,
args=None, options=None, seeds=None, target_tol=None, timeout=None)
brmesolve(H, psi0, tlist, a_ops=None, sec_cutoff=0.1, *,
c_ops=None, e_ops=None, args=None, options=None)
ssesolve(H, psi0, tlist, sc_ops=(), heterodyne=False, *,
e_ops=None, args=None, ntraj=500, options=None, seeds=None,
target_tol=None, timeout=None)
smesolve(H, rho0, tlist, c_ops=(), sc_ops=(), heterodyne=False, *,
e_ops=None, args=None, ntraj=500, options=None, seeds=None,
target_tol=None, timeout=None)In 5.3, e_ops, args, and options are keyword-only. Passing solver options as arbitrary solver keyword arguments was removed. The old qutip.Options export is no longer present; pass an ordinary dictionary.
sesolve: closed unitary evolution
import numpy as np
from qutip import basis, sesolve, sigmax, sigmaz
H = 0.5 * sigmax()
psi0 = basis(2, 0)
tlist = np.linspace(0.0, 10.0, 201)
result = sesolve(
H,
psi0,
tlist,
e_ops={"z": sigmaz()},
options={"atol": 1e-10, "rtol": 1e-8, "progress_bar": ""},
)
z = np.asarray(result.e_data["z"])For an ODE norm/trace audit, set options["normalize_output"] = False: sesolve/mesolve normally normalize an initially normalized state on output, which can conceal integrator drift. Quantum-jump trajectory normalization is part of the unravelling and is a different operation.
Audit Hamiltonian Hermiticity and state norm. If norm drift is material, tighten tolerances or investigate the model; do not normalize away unexplained error.
Raw lines 44 to 71mesolve: Lindblad or explicit Liouvillian evolution
import numpy as np
from qutip import basis, mesolve, sigmam, sigmaz
gamma = 0.2
excited = basis(2, 0)
tlist = np.linspace(0.0, 12.0, 241)
result = mesolve(
0.5 * sigmaz(),
excited,
tlist,
c_ops=[np.sqrt(gamma) * sigmam()],
e_ops={"p_excited": excited.proj()},
options={
"method": "adams",
"atol": 1e-10,
"rtol": 1e-8,
"store_final_state": True,
"progress_bar": "",
},
)When no collapse operators are supplied and H is not a superoperator, mesolve may defer to sesolve. If H is an explicit Liouvillian, document whether it is in valid Lindblad form or represents a deliberate approximation.
mcsolve: quantum jumps
result = mcsolve(
0.5 * sigmaz(),
excited,
tlist,
[np.sqrt(gamma) * sigmam()],
e_ops=[excited.proj()],
ntraj=500,
seeds=20260723,
options={
"keep_runs_results": False,
"progress_bar": "",
},
)
mean_population = result.average_expect[0]
trajectory_spread = result.std_expect[0]
seed_manifest = result.seedsseeds may be one integer/SeedSequence used to spawn trajectory seeds, or a list with one seed per trajectory. QuTiP stores the realized seeds in the result. Reusing them enables a paired comparison, but paired runs are not independent replicates.
Trajectory rigor:
- increase
ntrajand report stabilization or a target uncertainty; - distinguish trajectory standard deviation from standard error of the mean;
- set
options={"keep_runs_results": True}only when individual trajectories are actually required, because memory scales with trajectories and time points; - collapse records are available per trajectory through result attributes such as
collapse; do not print unbounded records by default; target_tolmay stop beforentraj, so report the number actually run;- report timeout termination and solver stats.
For mixed initial conditions, current QuTiP can sample the initial mixture; the result then includes initial-state accounting. State this extra source of sampling explicitly.
Raw lines 102 to 144brmesolve: Bloch-Redfield evolution
import numpy as np
from qutip import basis, brmesolve, sigmax, sigmaz
def one_sided_spectrum(w):
return 0.03 * w if w > 0.0 else 0.0
tlist = np.linspace(0.0, 30.0, 601)
result = brmesolve(
0.5 * sigmaz(),
basis(2, 0),
tlist,
a_ops=[(sigmax(), one_sided_spectrum)],
e_ops={"z": sigmaz()},
sec_cutoff=0.1,
options={"atol": 1e-10, "rtol": 1e-8, "progress_bar": ""},
)The coupling operator in each a_ops pair is normally Hermitian, and the spectrum is a function of angular frequency. Prefer a current QuTiP Environment object when it represents the bath more clearly.
Required checks:
- weak system-bath coupling (Born approximation);
- short bath memory compared with system dynamics (Markov approximation);
- stationary bath and correct positive/negative-frequency convention;
- secular choice:
sec_cutoff=-1disables secularization and can worsen positivity; - density-matrix trace, Hermiticity, and minimum eigenvalue over time.
See advanced.md for the physical boundaries.
Stochastic Schrödinger and master equations
Use these for diffusive continuous-measurement unravellings, not jump trajectories:
result = smesolve(
H,
rho0,
tlist,
c_ops=unmonitored_channels,
sc_ops=monitored_channels,
heterodyne=False, # homodyne
e_ops={"signal": measured_quadrature},
ntraj=200,
seeds=20260723,
options={"dt": 0.001, "store_measurement": "end", "progress_bar": ""},
)c_opsare unmonitored deterministic dissipation channels. Even from a ket, usesmesolveif any such channel is present;ssesolvehas noc_ops.- Stochastic methods include
platen,rouchon, andeuler, each with its own options. Do not pass deterministicadams/bdfor theiratol/rtolto a fixed-step stochastic integrator; convergedtinstead. sc_opsare monitored stochastic channels.heterodyne=Falseis homodyne;Trueis heterodyne.- Legacy integer
noiseselectors are not current API. - Measurement records can be much larger than expectation summaries; store them only when needed.
- Converge the stochastic integration step
dtseparately fromntraj. result.measurementhas shape(ntraj, n_sc_ops, len(tlist)-1)for homodyne and(ntraj, n_sc_ops, 2, len(tlist)-1)for heterodyne. Usestore_measurement="start"for replay withrun_from_experiment(..., measurement=True); the default/end record uses different state timing.
Time-dependent systems and QobjEvo
Raw lines 217 to 218Pythonic callable coefficients
import numpy as np
from qutip import QobjEvo, sigmax, sigmaz
def pulse(t, amplitude, center, width):
return amplitude * np.exp(-0.5 * ((t - center) / width) ** 2)
H = QobjEvo(
[0.5 * sigmaz(), [sigmax(), pulse]],
args={"amplitude": 0.2, "center": 5.0, "width": 1.0},
)
H_at_t = H(5.0)
H.arguments(amplitude=0.15)The Pythonic form f(t, parameter, ...) is current. The legacy f(t, args_dictionary) form is deprecated in 5.3 and scheduled for removal in 5.5.
Sampled coefficients
coefficient_times = np.linspace(0.0, 10.0, 501)
samples = np.cos(coefficient_times)
H = QobjEvo(
[0.5 * sigmaz(), [sigmax(), samples]],
tlist=coefficient_times,
order=3,
)Sample times must be sorted and match coefficient length. order=0 gives a left/previous-value step function; the default cubic spline can overshoot. Converge the coefficient sampling independently of solver output times.
QuTiP also accepts expression strings and may compile them, but this skill does not construct such expressions from configuration or user text. Use trusted callables or numeric arrays in generated workflows.
Raw lines 240 to 259Option dictionaries and integrators
Common solver options:
options = {
"method": "adams",
"atol": 1e-10,
"rtol": 1e-8,
"nsteps": 10000,
"store_states": False,
"store_final_state": True,
"progress_bar": "",
}Options are solver- and integrator-specific. Consult the selected solver's .options documentation before using a key.
Common integration choices:
adams: non-stiff default for many deterministic solvers;bdf: stiff systems;lsoda: switches between non-stiff and stiff methods;- explicit high-order methods such as
dop853,vern7, orvern9; diag: diagonalization-based constant-system evolution;krylov: suitable cases where Krylov evolution is beneficial.
An integrator label is not an accuracy certificate. Compare at least two tolerance levels, inspect warnings/stats, and compare a second method for a representative stiff or difficult case.
QuTiP 5.3 adds matrix_form for mesolve/MESolver:
options = {"matrix_form": True, "atol": 1e-10, "rtol": 1e-8}It uses matrix-matrix products and may reduce memory in suitable models. Benchmark both time and verified observables before adopting it.
Raw lines 260 to 300Time grids
tlist is the requested output grid, not necessarily the integrator's internal step sequence.
Checks:
- finite, strictly increasing values;
- includes the physically intended initial time;
- resolves the fastest Hamiltonian, decay, drive-envelope, and measurement scales in the returned output;
- long enough to capture transients or steady behavior;
- converged under a denser output grid where downstream interpolation, FFT, or peak detection depends on sampling.
For FFT spectra, a uniform taulist is required and its spacing/window set Nyquist range and frequency resolution.
Result semantics
Current solver results can contain:
| Attribute | Meaning |
|---|---|
times | returned times |
states | stored states; may be empty depending on options and e_ops |
final_state | final state when requested |
expect | list aligned with list-form e_ops |
e_data | dictionary keyed like dict-form e_ops |
options | effective result/solver options |
solver | solver name |
stats | timing and diagnostic statistics |
Multi-trajectory results add trajectory counts, seeds, standard deviations, average states, measurements, and optionally individual run results. Never assume .states means individual trajectories; inspect keep_runs_results and the concrete result type. For multi-trajectory results, .expect/.e_data and .states switch to per-run arrays when runs are retained. Use .average_expect/.average_e_data and .average_states explicitly for ensemble means, and .runs_expect/.runs_states for individual trajectories. Trajectory count is an unravelling sample count, not hardware measurement shots.
QuTiP 5.3 adds Result.plot_expect() and MultiTrajResult.plot_expect(). Prefer explicit axes in reusable code.
Repeated systems
Solver classes (SESolver, MESolver, MCSolver, BRSolver, SMESolver, and others) can reuse a constructed right-hand side across runs:
from qutip import MESolver
solver = MESolver(H, c_ops, options={"atol": 1e-10, "rtol": 1e-8})
first = solver.run(rho_a, tlist, e_ops=e_ops)
second = solver.run(rho_b, tlist, e_ops=e_ops)Use the class interface when repeated setup is material, and verify that updated arguments and initial states are the intended ones.
Raw lines 346 to 361Portable output
Do not load untrusted serialized Python or QuTiP objects. For exchange and audit, save:
- scalar configuration and assumptions;
- real/imaginary numeric arrays;
- dimensions, versions, tolerances, seeds, and solver stats;
- checksums and schema versions where long-term provenance matters.
The bundled CLIs use bounded strict JSON and never pickle results.
Raw lines 362 to 373Local tools
../scripts/two_level_simulation.py: boundedmesolve/mcsolveexample.../scripts/solver_config_planner.py: solver and option checklist.../scripts/convergence_sweep.py: deterministic or trajectory convergence.../scripts/result_audit.py: portable JSON audit.