Available entries
ConstantElectrolyte
Just sets the initial salt concentration; everything else is left to defaults or other entries.
NymanElectrolyte
Full set for LiPF in EC:EMC from Nyman et al. 2008. Concentration-dependent and , constant and . Isothermal.
LandesfeindElectrolyte
Full set with concentration and temperature dependence for three solvent systems (
EC:DMC (1:1), EC:EMC (3:7), EMC:FEC (19:1)) from Landesfeind & Gasteiger 2019.ArrheniusElectrolyte*
ArrheniusElectrolyteDiffusivity and ArrheniusElectrolyteConductivity wrap a reference or in an Arrhenius temperature factor. Useful when you have isothermal data and need to bolt on -dependence.Fitting your own coefficients
The six conductivity coefficients (and the diffusivity, thermodynamic-factor, and transference-number coefficients) insideLandesfeindElectrolyte are exposed as named parameters precisely so they can be replaced with fit unknowns. Override the relevant parameter names in the data-fit parameters dict and run a pipeline that includes the direct entry — the published values act as the base and the optimizer searches over the overridden ones.
To configure and submit the Landesfeind/Nyman direct entries with
ionworks-schema + ionworks-api, see Pipelines → Direct Entries.For the physics behind the four transport properties and how they are measured experimentally, see Electrolyte transport properties.