Publication | Closed Access

Phase diagram calculations in the Co–Mo and Fe–Mo systems using first-principles results for the sigma phase

Sigma PhaseEngineeringPhysicsPhase EquilibriumPhase Diagram CalculationsNatural SciencesCondensed Matter PhysicsQuantum MaterialsApplied PhysicsFe–mo SystemsComputational ChemistryChemistryQuantum ChemistryElectronic StructureAb-initio Method