Dynamics Simulation Results
The solver.Result Class
Before embarking on simulating the dynamics of quantum systems, we will first
look at the data structure used for returning the simulation results. This
object is a Result
class that stores all the
crucial data needed for analyzing and plotting the results of a simulation.
A generic Result
object result
contains the following properties for
storing simulation data:
Property |
Description |
---|---|
|
String indicating which solver was used to generate the data. |
|
List/array of times at which simulation data is calculated. |
|
List/array of expectation values, if requested. |
|
Dictionary of expectation values, if requested. |
|
List/array of state vectors/density matrices calculated at |
|
State vector or density matrix at the last time of the evolution. |
|
Various statistics about the evolution. |
Accessing Result Data
To understand how to access the data in a Result object we will use an example
as a guide, although we do not worry about the simulation details at this stage.
Like all solvers, the Master Equation solver used in this example returns an
Result object, here called simply result
. To see what is contained inside
result
we can use the print function:
>>> print(result)
<Result
Solver: mesolve
Solver stats:
method: 'scipy zvode adams'
init time: 0.0001876354217529297
preparation time: 0.007544517517089844
run time: 0.001268625259399414
solver: 'Master Equation Evolution'
num_collapse: 1
Time interval: [0, 1.0] (2 steps)
Number of e_ops: 1
State not saved.
>
The first line tells us that this data object was generated from the Master
Equation solver mesolve
. Next we have the statistics including the ODE
solver used, setup time, number of collpases. Then the integration interval is
described, followed with the number of expectation value computed. Finally, it
says whether the states are stored.
Now we have all the information needed to analyze the simulation results. To access the data for the two expectation values one can do:
expt0 = result.expect[0]
expt1 = result.expect[1]
Recall that Python uses C-style indexing that begins with zero (i.e., [0] => 1st collapse operator data). Alternatively, expectation values can be obtained as a dictionary:
e_ops = {"sx": sigmax(), "sy": sigmay(), "sz": sigmaz()}
...
expt_sx = result.e_data["sx"]
When e_ops
is a list, e_data
ca be used with the list index. Together
with the array of times at which these expectation values are calculated:
times = result.times
we can plot the resulting expectation values:
plot(times, expt0)
plot(times, expt1)
show()
State vectors, or density matrices, are accessed in a similar manner, although
typically one does not need an index (i.e [0]) since there is only one list for
each of these components. Some other solver can have other output,
heomsolve
’s results can have ado_states
output if the options
store_ados
is set, similarly, fmmesolve
can return
floquet_states
.
Multiple Trajectories Solver Results
Solver which compute multiple trajectories such as the Monte Carlo Equations Solvers or the Stochastics Solvers result will differ depending on whether the trajectories are flags to be saved. For example:
>>> mcsolve(H, psi, np.linspace(0, 1, 11), c_ops, e_ops=[num(N)], ntraj=25, options={"keep_runs_results": False})
>>> np.shape(result.expect)
(1, 11)
>>> mcsolve(H, psi, np.linspace(0, 1, 11), c_ops, e_ops=[num(N)], ntraj=25, options={"keep_runs_results": True})
>>> np.shape(result.expect)
(1, 25, 11)
When the runs are not saved, the expectation values and states are averaged
over all trajectories, while a list over the runs are given when they are stored.
For a fix output format, average_expect
return the average, while
runs_states
return the list over trajectories. The runs_
output will
return None
when the trajectories are not saved. Standard derivation of the
expectation values is also available:
Reduced result |
Trajectories results |
Description |
---|---|---|
|
|
State vectors or density matrices calculated at each times of tlist |
|
|
State vectors or density matrices calculated at the last time of tlist |
|
|
List/array of expectation values, if requested. |
|
List/array of standard derivation of the expectation values. |
|
|
|
Dictionary of expectation values, if requested. |
|
Dictionary of standard derivation of the expectation values. |
Multiple trajectories results also keep the trajectories seeds
to allows
recomputing the results.
seeds = result.seeds
One last feature specific to multi-trajectories results is the addition operation that can be used to merge sets of trajectories.
>>> run1 = smesolve(H, psi, np.linspace(0, 1, 11), c_ops, e_ops=[num(N)], ntraj=25)
>>> print(run1.num_trajectories)
25
>>> run2 = smesolve(H, psi, np.linspace(0, 1, 11), c_ops, e_ops=[num(N)], ntraj=25)
>>> print(run2.num_trajectories)
25
>>> merged = run1 + run2
>>> print(merged.num_trajectories)
50
This allows one to improve statistics while keeping previous computations.