Structure and stability of borohydride on Au(111) and Au3M(111) (M = Cr, Mn, Fe, Co, Ni) surfaces

Dalton Transactions

Volumn 42, Issue 3, 2013, Pages 770-775

  Arevalo, Ryan Lacdao ^a,b   Escaño, Mary Clare Sison ^a   Wang, Andrew Yu Sheng ^c   Kasai, Hideaki ^a  

^a OSAKA UNIVERSITY   (Japan)

^b PHILIPPINE NORMAL UNIVERSITY   (Philippines)

^c UNIVERSITY OF BRITISH COLUMBIA   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

ALLOY SURFACES; ALLOYING METALS; ANODE CATALYSTS; ANTI-BONDING STATE; AU(1 1 1 ); AU-BASED ALLOY; BOND ELONGATION; BOROHYDRIDES; FIRST-PRINCIPLES CALCULATION; MOLECULAR ADSORPTION; SPIN-POLARIZED DENSITY FUNCTIONAL THEORY; SURFACE BONDING; UNOCCUPIED STATE;

ADSORPTION; ALLOYING; ALLOYS; CALCULATIONS; CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; MANGANESE;

CHROMIUM;

EID: 84871268189     PISSN: 14779226     EISSN: 14779234     Source Type: Journal    
DOI: 10.1039/c2dt32226a     Document Type: Article

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