xnn.common.models.charge_solve.charge_energy#

xnn.common.models.charge_solve.charge_energy(chi, hardness, q)[source]#

Per-atom chi_i q_i + 1/2 J_i q_i^2, (n,); the Ewald part is EwaldSummation’s energy of the same charges.

Parameters:
Return type:

Tensor