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Function index
asche1 edited this page Jan 25, 2021
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Class | Description |
---|---|
Ligands |
Stores the ligands and performs point-charge calculations |
CFLevels |
Builds CEF Hamiltonian and calculates properties |
LS_Ligands |
Stores the ligands and performs point-charge calculations |
LS_CFLevels |
Builds CEF Hamiltonian and calculates properties |
Function | Description |
---|---|
importCIF |
Builds point charge model from .cif file |
Function | Description |
---|---|
WybourneToStevens |
Converts CEF parameters from the Wybourne formalism to the Stevens formalism |
rescaleCEF |
rescales CEF parameters from one RE ion to another |