jaxrts.models.AverageAtom_Sii

class jaxrts.models.AverageAtom_Sii(rmin: ~pint.registry.Quantity = <Quantity(0.001, 'bohr')>, rmax: ~pint.registry.Quantity = <Quantity(100, 'bohr')>, pot: int = 14, mix: float = 0.0, tmult: list[float] = None)

This model performs a HNC calculation, assuming one average atom with a given, average charge state. While it might lead to reasonable results, this is not tested and takes some computation time.

Methods

__init__([rmin, rmax, pot, mix, tmult])
check(plasma_state)	Test if the model is applicable to the PlasmaState.
citation([style, comment])	Return bibliographic information for the Model used.
evaluate(plasma_state, setup)
prepare(plasma_state, key)	Modify the plasma_state in place.

Attributes

allowed_keys	A list of keywords where this model is adequate for
cite_keys	A list of bibtex keys.
k
r
r_max	The maximal radius for evaluating the potentials.
pot	The exponent (2 ** pot), setting the number of points in r or k to evaluate.
mix	Value in [0, 1); describes how much of the last iterations' nodal correction term should be added to the newly obtained N_ab.
tmult	List of temperature multipliers used in auxiliary HNC calculations.