amep.spatialcor#

Spatial Correlation Functions#

The AMEP module amep.spatialcor provides methods that calculate spatial correlation functions for a single frame of particle-based data.

Functions

pcf2d(coords, box_boundary[, other_coords, ...])

Calculates the 2D pair correlation function by calculating histograms.

pcf_angle(coords, box_boundary[, ...])

Calculate the angle dependent radial pair correlation function.

rdf(coords, box_boundary[, other_coords, ...])

Calculate the radial pair-distribution function for a single frame.

sf2d(coords, box_boundary[, other_coords, ...])

Calculates the 2d static structure factor.

sfiso(coords, box_boundary, N[, qmax, twod, ...])

Calculates the isotropic static structure factor for a given set of coordinates.

spatialcor(coords, box_boundary, values[, ...])

Calculates the spatial correlation function of the values for atoms at positions given by coords.