Package _global.tri.oxidationstates.structure

package _global.tri.oxidationstates.structure

Related Packages

Package	Description
_global.tri.oxidationstates
_global.tri.oxidationstates.calculator
_global.tri.oxidationstates.fitting
_global.tri.oxidationstates.ion
_global.tri.oxidationstates.util
_global.tri.oxidationstates.webapi

Classes

Class	Description
LatticeOptimizer	This class is used to find an "average" lattice given a set of target lattices.
StructureOptimizer	Finds a structure that is the average of a set of given structures, as determined by the mean squared log ratio of the elements of the minimum-distance matrices for the structures.