jaxrts.hypernetted_chain.S_ii_HNC

jaxrts.hypernetted_chain.S_ii_HNC(k: Quantity, pdf, ni, r)[source]: Calculates the static structure factor for an isotropic system from the pair distribution function obtained used the HNC approach.

Note

Due to the numerical implementation of sinft(), we force the entry S_ii[0] to the value S_ii[1], as it would be always unity, otherwise.

Examples using `jaxrts.hypernetted_chain.S_ii_HNC`

Compare HNC Calculations to Gregori.2006

Compare HNC Calculations to Gregori.2006

HNC: Multicomponent

HNC: Multicomponent

Static structure factor of the electron-ion system

Static structure factor of the electron-ion system

HNC-SVT: multi-component, multi-temperature (M-SVT)

HNC-SVT: multi-component, multi-temperature (M-SVT)

HNC calculations with Quantum exchange potentials

HNC calculations with Quantum exchange potentials