Wavepacket
General
Architecture overview
Representation of states
License and Citation
Introductory tutorials
Getting started
Calculating eigenstates and -energies of operators
Plotting wave functions and density operators
Using Chebychev solvers
Ground-state relaxation and finite temperatures
Advanced usage and theory
Pendular states
Representing states at finite temperature
Background theory: Converging equally-spaced grids
Background theory: ODE solvers
Background theory: Polynomial solvers
Other links
Project homepage
Issue tracker
Wavepacket wiki
API
API Reference
Wavepacket
Index
Index
A
|
B
|
C
|
D
|
E
|
F
|
G
|
I
|
L
|
M
|
N
|
O
|
P
|
R
|
S
|
T
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U
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V
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W
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X
|
Y
|
Z
A
alpha (wavepacket.solver.ChebychevSolver attribute)
(wavepacket.solver.RelaxationSolver attribute)
AnyData (in module wavepacket.typing)
apply() (wavepacket.expression.CommutatorLiouvillian method)
(wavepacket.expression.ExpressionBase method)
(wavepacket.expression.ExpressionSum method)
(wavepacket.expression.OneSidedLiouvillian method)
(wavepacket.expression.SchroedingerEquation method)
(wavepacket.operator.OperatorBase method)
apply_from_left() (wavepacket.operator.Constant method)
(wavepacket.operator.FbrOperator1D method)
(wavepacket.operator.OperatorBase method)
(wavepacket.operator.PlaneWaveFbrOperator method)
(wavepacket.operator.Potential1D method)
(wavepacket.operator.Projection method)
(wavepacket.operator.TimeDependentOperator method)
(wavepacket.testing.DummyOperator method)
apply_from_right() (wavepacket.operator.Constant method)
(wavepacket.operator.FbrOperator1D method)
(wavepacket.operator.OperatorBase method)
(wavepacket.operator.PlaneWaveFbrOperator method)
(wavepacket.operator.Potential1D method)
(wavepacket.operator.Projection method)
(wavepacket.operator.TimeDependentOperator method)
(wavepacket.testing.DummyOperator method)
apply_to_wave_function() (wavepacket.operator.Constant method)
(wavepacket.operator.FbrOperator1D method)
(wavepacket.operator.OperatorBase method)
(wavepacket.operator.PlaneWaveFbrOperator method)
(wavepacket.operator.Potential1D method)
(wavepacket.operator.Projection method)
(wavepacket.operator.TimeDependentOperator method)
(wavepacket.testing.DummyOperator method)
assert_close() (in module wavepacket.testing)
B
BadFunctionCall
BadGridError
BadStateError
BaseContourPlot2D (class in wavepacket.plot)
BasePlot1D (class in wavepacket.plot)
broadcast() (wavepacket.grid.Grid method)
C
CartesianKineticEnergy (class in wavepacket.operator)
ChebychevSolver (class in wavepacket.solver)
CommutatorLiouvillian (class in wavepacket.expression)
ComplexData (in module wavepacket.typing)
Constant (class in wavepacket.operator)
ContourPlot2D (class in wavepacket.plot)
contours (wavepacket.plot.BaseContourPlot2D attribute)
D
data (wavepacket.grid.State attribute)
diagonalize() (in module wavepacket)
direct_product() (in module wavepacket.builder)
DofBase (class in wavepacket.grid)
dofs (wavepacket.grid.Grid attribute)
dt (wavepacket.solver.SolverBase attribute)
DummyDof (class in wavepacket.testing)
DummyOperator (class in wavepacket.testing)
dvr_density() (in module wavepacket)
dvr_points (wavepacket.grid.DofBase attribute)
E
ExecutionError
expectation_value() (in module wavepacket)
ExpressionBase (class in wavepacket.expression)
ExpressionSum (class in wavepacket.expression)
F
fbr_density() (in module wavepacket)
fbr_points (wavepacket.grid.DofBase attribute)
FbrOperator1D (class in wavepacket.operator)
figure (wavepacket.plot.ContourPlot2D attribute)
(wavepacket.plot.StackedContourPlot2D attribute)
from_dvr() (wavepacket.grid.DofBase method)
(wavepacket.grid.PlaneWaveDof method)
(wavepacket.grid.SphericalHarmonicsDof method)
(wavepacket.testing.DummyDof method)
from_fbr() (wavepacket.grid.DofBase method)
(wavepacket.grid.PlaneWaveDof method)
(wavepacket.grid.SphericalHarmonicsDof method)
(wavepacket.testing.DummyDof method)
G
Gaussian (class in wavepacket.special)
Generator (in module wavepacket.typing)
Grid (class in wavepacket.grid)
grid (wavepacket.grid.State attribute)
(wavepacket.operator.OperatorBase attribute)
I
inertia (wavepacket.operator.RotationalKineticEnergy attribute)
InvalidValueError
is_density_operator() (wavepacket.grid.State method)
is_wave_function() (wavepacket.grid.State method)
L
LaserField (class in wavepacket.operator)
LEFT (wavepacket.expression.OneSidedLiouvillian.Side attribute)
lmax (wavepacket.grid.SphericalHarmonicsDof attribute)
log() (in module wavepacket)
M
m (wavepacket.grid.SphericalHarmonicsDof attribute)
mass (wavepacket.operator.CartesianKineticEnergy attribute)
max_marginals (wavepacket.plot.ContourPlot2D attribute)
module
wavepacket
wavepacket.builder
wavepacket.expression
wavepacket.grid
wavepacket.operator
wavepacket.plot
wavepacket.solver
wavepacket.special
wavepacket.testing
wavepacket.typing
N
normalize() (in module wavepacket)
normalize_index() (wavepacket.grid.Grid method)
O
OdeSolver (class in wavepacket.solver)
OneSidedLiouvillian (class in wavepacket.expression)
OneSidedLiouvillian.Side (class in wavepacket.expression)
operator_broadcast() (wavepacket.grid.Grid method)
operator_shape (wavepacket.grid.Grid attribute)
OperatorBase (class in wavepacket.operator)
order (wavepacket.solver.ChebychevSolver attribute)
(wavepacket.solver.RelaxationSolver attribute)
orthonormalize() (in module wavepacket)
P
PlaneWave (class in wavepacket.special)
PlaneWaveDof (class in wavepacket.grid)
PlaneWaveFbrOperator (class in wavepacket.operator)
plot() (wavepacket.plot.BaseContourPlot2D method)
(wavepacket.plot.BasePlot1D method)
(wavepacket.plot.ContourPlot2D method)
(wavepacket.plot.SimplePlot1D method)
(wavepacket.plot.StackedContourPlot2D method)
(wavepacket.plot.StackedPlot1D method)
population() (in module wavepacket)
Potential1D (class in wavepacket.operator)
product_wave_function() (in module wavepacket.builder)
Projection (class in wavepacket.operator)
propagate() (wavepacket.solver.SolverBase method)
pure_density() (in module wavepacket.builder)
R
random_state() (in module wavepacket.testing)
random_wave_function() (in module wavepacket.builder)
RealData (in module wavepacket.typing)
RealGenerator (in module wavepacket.typing)
RelaxationSolver (class in wavepacket.solver)
RIGHT (wavepacket.expression.OneSidedLiouvillian.Side attribute)
RotationalKineticEnergy (class in wavepacket.operator)
S
SchroedingerEquation (class in wavepacket.expression)
shape (wavepacket.grid.Grid attribute)
SimplePlot1D (class in wavepacket.plot)
SinSquare (class in wavepacket.special)
size (wavepacket.grid.DofBase attribute)
(wavepacket.grid.Grid attribute)
SoftRectangularFunction (class in wavepacket.special)
SolverBase (class in wavepacket.solver)
SphericalHarmonic (class in wavepacket.special)
SphericalHarmonicsDof (class in wavepacket.grid)
StackedContourPlot2D (class in wavepacket.plot)
StackedPlot1D (class in wavepacket.plot)
State (class in wavepacket.grid)
step() (wavepacket.solver.ChebychevSolver method)
(wavepacket.solver.OdeSolver method)
(wavepacket.solver.RelaxationSolver method)
(wavepacket.solver.SolverBase method)
T
time_dependent (wavepacket.expression.ExpressionBase attribute)
(wavepacket.operator.OperatorBase attribute)
TimeDependentOperator (class in wavepacket.operator)
to_dvr() (wavepacket.grid.DofBase method)
(wavepacket.grid.PlaneWaveDof method)
(wavepacket.grid.SphericalHarmonicsDof method)
(wavepacket.testing.DummyDof method)
to_fbr() (wavepacket.grid.DofBase method)
(wavepacket.grid.PlaneWaveDof method)
(wavepacket.grid.SphericalHarmonicsDof method)
(wavepacket.testing.DummyDof method)
trace() (in module wavepacket)
U
unit_density() (in module wavepacket.builder)
unit_wave_function() (in module wavepacket.builder)
V
value (wavepacket.operator.Constant attribute)
W
wavepacket
module
wavepacket.builder
module
wavepacket.expression
module
wavepacket.grid
module
wavepacket.operator
module
wavepacket.plot
module
wavepacket.solver
module
wavepacket.special
module
wavepacket.testing
module
wavepacket.typing
module
X
xlim (wavepacket.plot.BaseContourPlot2D attribute)
(wavepacket.plot.BasePlot1D attribute)
Y
ylim (wavepacket.plot.BaseContourPlot2D attribute)
Z
zero_density() (in module wavepacket.builder)
zero_wave_function() (in module wavepacket.builder)