ChemicalReference.hh File Reference

#include "casm/clex/Reference.hh"

Go to the source code of this file.

Classes
struct	CASM::ChemicalReferenceState
	Stores the composition and energy in a single reference state. More...
class	CASM::ChemicalReference
struct	CASM::ChemicalReferencePrinter
	BasicStructure to help print ChemicalReference. More...

Namespaces
	CASM
	Main CASM namespace.
	CASM::xtal

Functions
ChemicalReference	CASM::auto_chemical_reference (const PrimClex &primclex, double lin_alg_tol)
	Automatically set ChemicalReference using calculated Configurations with 'extreme' compositions. More...