Enhancing the thermoelectric properties of layered transition-metal dichalcogenides 2H-MQ2 (M = Mo, W; Q = S, Se, Te) by layer mixing: Density functional investigation

Chemistry of Materials

Volumn 25, Issue 18, 2013, Pages 3745-3752

  Lee, Changhoon ^a,b   Hong, Jisook ^a   Whangbo, Myung Hwan ^b   Shim, Ji Hoon ^a  

^a Pohang University of Science and Technology (POSTECH)   (South Korea)

^b NORTH CAROLINA STATE UNIVERSITY   (United States)

Author keywords

density functional calculation; layer mixing; layered transition metal dichalcogenide; thermoelectric property

Indexed keywords

DENSITY FUNCTIONALS; DICHALCOGENIDES; DIFFERENT LAYERS; LAYER MIXING; LAYERED TRANSITION-METAL DICHALCOGENIDE; PURE COMPONENTS; THERMOELECTRIC PROPERTIES; VAN DER WAALS INTERACTIONS;

DENSITY FUNCTIONAL THEORY; THERMOELECTRICITY; TRANSITION METALS; TUNGSTEN COMPOUNDS; VAN DER WAALS FORCES;

THERMOELECTRIC EQUIPMENT;

EID: 84884833267     PISSN: 08974756     EISSN: 15205002     Source Type: Journal    
DOI: 10.1021/cm402281n     Document Type: Article

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