A reactive force field molecular dynamics simulation study of corrosion of nickel

Defect and Diffusion Forum

Volumn 323-325, Issue , 2012, Pages 139-145

  Assowe, O ^a   Politano, O ^a   Vignal, V ^a   Arnoux, P ^b   Diawara, B ^c  

^a UNIVERSITÉ DE BOURGOGNE   (France)

^b DIF   (France)

^c PSL RESEARCH UNIVERSITY   (France)

Author keywords

Adsorption; Molecular dynamic; Nickel; ReaxFF; Water

Indexed keywords

ADSORPTION; CORROSION; HYDROGEN BONDS; MOLECULES; NICKEL; SINGLE CRYSTAL SURFACES; SINGLE CRYSTALS; WATER;

CATALYTIC PROPERTIES; CORROSION PROCESS; HYDROCARBON CHEMISTRY; MOLECULAR DYNAMICS SIMULATIONS; NICKEL SURFACES; REACTIVE FORCE FIELD; REAXFF; WATER MOLECULE;

MOLECULAR DYNAMICS;

EID: 84860797328     PISSN: 10120386     EISSN: 16629507     Source Type: Journal    
DOI: 10.4028/www.scientific.net/DDF.323-325.139     Document Type: Conference Paper

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