Energetics of oxidation in MoS2 nanoparticles by density functional theory

Journal of Physical Chemistry C

Volumn 115, Issue 21, 2011, Pages 10606-10616

  Liang, Tao ^a   Sawyer, W Gregory ^a,b   Perry, Scott S ^a   Sinnott, Susan B ^a   Phillpot, Simon R ^a  

^a University of Florida   (United States)

^b UNIVERSITY OF FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC OXYGEN; COORDINATED SITES; ELECTROSTATIC ENERGIES; TRILAYERS;

BINDING ENERGY; CHARGE TRANSFER; ELECTRONIC DENSITY OF STATES; ELECTROSTATICS; ION EXCHANGE; MOLYBDENUM; MOLYBDENUM COMPOUNDS; NANOPARTICLES; OXIDATION; OXYGEN;

DENSITY FUNCTIONAL THEORY;

EID: 79957729531     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp110562n     Document Type: Article

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