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First-principles calculations to investigate electronic, optical, thermodynamic and thermoelectric properties of new Na6ZnX4 (X=O, S, Se) ternary alloys

Materials EngineeringMaterials ScienceFirst-principles CalculationsOptical MaterialsEngineeringTransition Metal ChalcogenidesCondensed Matter PhysicsApplied PhysicsNew Na6znx4Alloy PhaseThermoelectric Properties