Difference between revisions of "Kinetics.m"
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{{DISPLAYTITLE:kinetics.m}} __NOTOC__ | {{DISPLAYTITLE:kinetics.m}} __NOTOC__ | ||
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Chemical kinetics superoperator. | Chemical kinetics superoperator. | ||
==Syntax== | ==Syntax== | ||
| − | K=kinetics(spin_system) | + | K=kinetics(spin_system) |
| − | == | + | ==Parameters== |
| − | spin_system - Spinach spin system description object | + | spin_system - Spinach spin system description object |
produced as described in the [[spin_system_specification|spin system]] | produced as described in the [[spin_system_specification|spin system]] | ||
and [[basis_set_specification|basis]] specification sections, of the | and [[basis_set_specification|basis]] specification sections, of the | ||
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==Outputs== | ==Outputs== | ||
| − | K - kinetics superoperator | + | K - kinetics superoperator. If a Liouvillian is |
| − | + | assembled manually, this dissipative super- | |
| − | + | operator must enter as 1i*K, for example | |
| − | + | L=H+1i*R+1i*K | |
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==Notes== | ==Notes== | ||
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# A large variety of chemical reaction models is supported, see the [[chemical kinetics parameters]] section of the online manual. | # A large variety of chemical reaction models is supported, see the [[chemical kinetics parameters]] section of the online manual. | ||
| − | # Spinach [[kernel_contexts|context functions]] include kinetics superoperators into the total Liovillian automatically. | + | # Spinach [[kernel_contexts|context functions]] include relaxation and kinetics superoperators into the total Liovillian automatically. |
==See also== | ==See also== | ||
| − | + | [[relaxation.m]], [[hamiltonian.m]], [[lindbladian.m]], [[magpump.m]], [[bos2ist.m]], [[boson_mono.m]], [[boson_ortho.m]], [[centrans.m]], [[ct2ist.m]], [[enlev2bm.m]], [[enlev2ist.m]], [[equilibrate.m]], [[flow_gen.m]], [[oper2bm.m]], [[oper2ist.m]], [[operator.m]], [[orientation.m]], [[propagator.m]], [[react_gen.m]], [[sin_tran.m]], [[weyl.m]], [[Kernel_functions]], [[Kernel_utilities]] | |
| − | [[relaxation.m]], [[hamiltonian.m]], [[lindbladian.m]], [[magpump.m]] | ||
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''Version 2.2, authors: [[Ilya Kuprov]], [[Luke Edwards]], [[Hannah Hogben]]'' | ''Version 2.2, authors: [[Ilya Kuprov]], [[Luke Edwards]], [[Hannah Hogben]]'' | ||
Latest revision as of 06:52, 30 August 2026
Chemical kinetics superoperator.
Syntax
K=kinetics(spin_system)
Parameters
spin_system - Spinach spin system description object
produced as described in the spin system
and basis specification sections, of the
of the online manual. All adjustable pa-
rameters are described in the chemical
kinetics parameters section.
Outputs
K - kinetics superoperator. If a Liouvillian is
assembled manually, this dissipative super-
operator must enter as 1i*K, for example
L=H+1i*R+1i*K
Notes
- A large variety of chemical reaction models is supported, see the chemical kinetics parameters section of the online manual.
- Spinach context functions include relaxation and kinetics superoperators into the total Liovillian automatically.
See also
relaxation.m, hamiltonian.m, lindbladian.m, magpump.m, bos2ist.m, boson_mono.m, boson_ortho.m, centrans.m, ct2ist.m, enlev2bm.m, enlev2ist.m, equilibrate.m, flow_gen.m, oper2bm.m, oper2ist.m, operator.m, orientation.m, propagator.m, react_gen.m, sin_tran.m, weyl.m, Kernel_functions, Kernel_utilities
Version 2.2, authors: Ilya Kuprov, Luke Edwards, Hannah Hogben
