Package _global.tri.oxidationstates.ion
package _global.tri.oxidationstates.ion
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ClassDescriptionFind networks of atoms that are polyatomic ions, where the composition of the network(per unit cell) can be found in a list of compositions.This is a general interface for all ion findersThis class assigns ions to sites in a way that minimizes the global instability indexThis class keeps track of available polyatomic and monatomci ions.An Ion is a combination of an ion type (e.g.This class represents an ion type, which is an atom (or cluster of atoms) that can be assigned an oxidation state.This class identifies known polyatomic ions in a given structure.This class finds polyatomic ions that are networks of atoms in consisting of oxygen atoms boudn to one of the following elements: boron, carbon, nitrogen, aluminum, silicon, germanium, tin, lead, phosphorus, sulfur, arsenic, selenium, chlorine, bromine, chromium, molybdenum, tungsten,Finds possible Zintl ions in the given structure, where a possible Zintl ion is defined as a covalently bound network of ions containing one or more of boron, carbon, silicon, phosphorus, sulfur, gallium, germanium, arsenic, selenium, indium, tin, antimony, tellurium, lead, bismuth, polonium.