coulomb

This is summary documentation for hippynn.layers.physics.coulomb module. Click here for full documentation.

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Layers for physical operations

Functions

change_tanh_range(vals, minn, maxx)

Map [-1,1] to [min, max]

Classes

AlphaScreening(alpha)
ChEQ([units, lower_bound])
CombineScreenings(screening_list)	Returns products of different screenings for Screened Coulomb Interactions.
CoulombEnergy(energy_conversion_factor)	Computes the Coulomb Energy of the molecule/configuration.
EwaldRealSpaceScreening(alpha)
LocalDampingCosine(alpha)	Local damping using complement of the hipnn cutoff function.
QScreening(p_value)
ScreenedCoulombEnergy(...[, radius])	Computes the Coulomb Energy of the molecule/configuration.
WolfScreening(alpha)