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Structural, electronic, optical and thermodynamic investigations of NaXF 3 (X = Ca and Sr): First-principles calculations

Materials ScienceTransition Metal ChalcogenidesFirst-principles CalculationsEngineeringCondensed Matter PhysicsApplied PhysicsNaxf 3Thermodynamic InvestigationsElectronic StructureCrystallographyCrystal Structure Design