Ab initio study of dissociation reaction of ethylene molecules on Ni cluster

Journal of Physics: Conference Series

Volumn 454, Issue 1, 2013, Pages

  Shimamura, K ^a   Oguri, T ^b   Shibuta, Y ^b   Ohmura, S ^c   Shimojo, F ^a   Yamaguchi, S ^b  

^a KUMAMOTO UNIVERSITY   (Japan)

^b UNIVERSITY OF TOKYO   (Japan)

^c KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CHEMICAL ACTIVATION; DISSOCIATION; ETHYLENE; MOLECULAR DYNAMICS; MOLECULES; NICKEL; REACTION KINETICS;

AB INITIO MOLECULAR DYNAMICS SIMULATION; AB INITIO STUDY; ADSORPTION ENERGIES; DISSOCIATION REACTIONS; ETHYLENE MOLECULES; HYDROGEN ATOMS; HYDROGEN DISSOCIATION; MICROSCOPIC PROCESS;

ACTIVATION ENERGY;

EID: 84878058256     PISSN: 17426588     EISSN: 17426596     Source Type: Conference Proceeding    
DOI: 10.1088/1742-6596/454/1/012022     Document Type: Conference Paper

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