pairfinder module

Full Documentation for hippynn.interfaces.ase_interface.pairfinder module. Click here for a summary page.

class ASENeighbors(dist_hard_max)[source]

Bases: _DispatchNeighbors

compute_one(positions, cell)[source]
class ASEPairNode(name, parents, dist_hard_max, module='auto', module_kwargs=None, **kwargs)[source]

Bases: _DispatchNeighbors

ASE_compute_neighbors(cutoff, positions, cell)[source]