DFT investigation on CO sensing characteristics of hexagonal and orthorhombic WO3 nanostructures

Superlattices and Microstructures

Volumn 78, Issue , 2015, Pages 22-39

  Nagarajan, V ^a   Chandiramouli, R ^a  

^a SASTRA UNIVERSITY   (India)

Author keywords

Adsorbed energy; Adsorption; Mulliken population; Nanostructure; WO3

Indexed keywords

ADSORPTION; ELECTRON AFFINITY; ELECTRONIC PROPERTIES; IONIZATION POTENTIAL; NANOSTRUCTURES; STABILITY;

ADSORBED ENERGY; ADSORPTION CHARACTERISTIC; DENSITY OF STATE; MULLIKEN POPULATION ANALYSIS; MULLIKEN POPULATIONS; ORTHORHOMBIC PHASIS; STRUCTURAL STABILITIES; WO3;

DENSITY FUNCTIONAL THEORY;

EID: 84919696956     PISSN: 07496036     EISSN: 10963677     Source Type: Journal    
DOI: 10.1016/j.spmi.2014.11.027     Document Type: Article

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