jaxrts.elements

This submodule contains data for different chemical elements.

Functions

electron_distribution(atomic_number)

Returns number of electrons for each orbital (defined by the quantum numbers n and l) for a neutral atom with the given atomic_number.

electron_distribution_ionized_state(Z_core)

Interpolate between electron populations if the number of core electrons is not an integer.

Classes

Element(identifier)

Ionization(Z)

This class contains information of the ionization states of an atom.

MixElement(Zmix, avgMass[, name])

This helper class is used to define Average Atoms to perform calculations on.