Adsorption and decomposition of NH3 on Ir(111): A density functional theory study

Surface Science

Volumn 616, Issue , 2013, Pages 29-35

  Huang, Wuying ^a   Cheng, Chun ^a   Feng, Eryin ^a  

^a ANHUI NORMAL UNIVERSITY   (China)

Author keywords

Adsorption; Ammonia; Decomposition; Density functional theory calculation; Ir(111) surface

Indexed keywords

ACTIVATION BARRIERS; DENSITY FUNCTIONAL THEORY STUDIES; FREQUENCY ANALYSIS; IR(111); NITROGEN DESORPTION; RATE-LIMITING STEPS; RECOMBINATIVE DESORPTION; ZERO-POINT ENERGY CORRECTION;

ACTIVATION ENERGY; ADSORPTION; AMMONIA; DECOMPOSITION; DEHYDROGENATION; DENSITY FUNCTIONAL THEORY; DESORPTION; IRIDIUM;

GAS ADSORPTION;

EID: 84880922302     PISSN: 00396028     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.susc.2013.06.001     Document Type: Article

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