Difference between revisions of "Kinetics.m"
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| − | {{DISPLAYTITLE:kinetics.m}} | + | {{DISPLAYTITLE:kinetics.m}} __NOTOC__ |
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Chemical kinetics superoperator. | Chemical kinetics superoperator. | ||
==Syntax== | ==Syntax== | ||
| − | + | K=kinetics(spin_system) | |
==Arguments== | ==Arguments== | ||
| − | + | 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 | ||
| Line 17: | Line 18: | ||
==Outputs== | ==Outputs== | ||
| − | + | K - kinetics superoperator | |
| + | |||
| + | Note: a large variety of chemical reaction models is supported, | ||
| + | see the chemical kinetics parameters section of the onli- | ||
| + | ne manual. | ||
| + | |||
| + | Note: Spinach context functions include kinetics superoperators | ||
| + | into the total Liovillian automatically. | ||
| + | |||
| + | ilya.kuprov@weizmann.ac.il | ||
| + | ledwards@cbs.mpg.de | ||
| + | hannah.hogben@chem.ox.ac.uk | ||
==Notes== | ==Notes== | ||
| + | |||
# 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 kinetics superoperators into the total Liovillian automatically. | ||
==See also== | ==See also== | ||
| + | |||
[[relaxation.m]], [[hamiltonian.m]], [[lindbladian.m]], [[magpump.m]] | [[relaxation.m]], [[hamiltonian.m]], [[lindbladian.m]], [[magpump.m]] | ||
''Version 2.2, authors: [[Ilya Kuprov]], [[Luke Edwards]], [[Hannah Hogben]]'' | ''Version 2.2, authors: [[Ilya Kuprov]], [[Luke Edwards]], [[Hannah Hogben]]'' | ||
Revision as of 15:06, 5 April 2026
Chemical kinetics superoperator.
Syntax
K=kinetics(spin_system)
Arguments
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
Note: a large variety of chemical reaction models is supported,
see the chemical kinetics parameters section of the onli-
ne manual.
Note: Spinach context functions include kinetics superoperators
into the total Liovillian automatically.
ilya.kuprov@weizmann.ac.il ledwards@cbs.mpg.de hannah.hogben@chem.ox.ac.uk
Notes
- A large variety of chemical reaction models is supported, see the chemical kinetics parameters section of the online manual.
- Spinach context functions include kinetics superoperators into the total Liovillian automatically.
See also
relaxation.m, hamiltonian.m, lindbladian.m, magpump.m
Version 2.2, authors: Ilya Kuprov, Luke Edwards, Hannah Hogben
