First Principles Study of Structural and Thermodynamic Properties of the Ternary CsAlS<sub>2</sub> and NaAlS<sub>2</sub> Compounds

David Tshwane

[PS1-81] First Principles Study of Structural and Thermodynamic Properties of the Ternary CsAlS₂ and NaAlS₂ Compounds

*David Tshwane¹, Steve Dima¹, Prettier Maleka¹, Eric Maluta², Mysore Santoch³, Regina Maphanga¹ (1. Council for Scientific and Industrial Research (South Africa), 2. University of Venda (South Africa), 3. Council for Scientific and Industrial Research (India))

Keywords:Density Functional Theory, Electronic Properties

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Poster 1

[PS1-81] First Principles Study of Structural and Thermodynamic Properties of the Ternary CsAlS₂ and NaAlS₂ Compounds

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Presentation information

Poster 1

[PS1-81] First Principles Study of Structural and Thermodynamic Properties of the Ternary CsAlS2 and NaAlS2 Compounds

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[PS1-81] First Principles Study of Structural and Thermodynamic Properties of the Ternary CsAlS₂ and NaAlS₂ Compounds