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Issue Date
Title
Author(s)
2008
Associative versus dissociative binding of CO to 4d transition metal trimers: A density functional study
Addicoat, M.
;
Buntine, M.
;
Yates, B.
;
Metha, G.
2007
BFW: A density functional for transition metal clusters
Addicoat, M.
;
Buntine, M.
;
Metha, G.
;
Gilbert, A.
;
Gill, P.
2004
Photoionization of Nb₃CO and Nb₃ (CO)₂: is CO molecularly or dissociatively adsorbed on niobium?
Pederson, D.
;
Rayner, D.
;
Simard, B.
;
Addicoat, M.
;
Buntine, M.
;
Metha, G.
;
Fielicke, A.
2004
DFT calculations on group 5 mixed metal tetramers: TaxNbyVz (x+y+z=4)
Addicoat, M.
;
Buntine, M.
;
Metha, G.
2005
Ionization potentials of tantalum-carbide clusters: An experimental and density functional theory study
Dryza, V.
;
Addicoat, M.
;
Gascooke, J.
;
Buntine, M.
;
Metha, G.
2009
Photoionization efficiency spectroscopy and density functional theory investigations of RhHo2On, (n=0-2) clusters
Gentleman, A.
;
Addicoat, M.
;
Dryza, V.
;
Gascooke, J.
;
Buntine, M.
;
Metha, G.
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Author
6
Metha, G.
2
Dryza, V.
2
Gascooke, J.
1
Fielicke, A.
1
Gentleman, A.
1
Gilbert, A.
1
Gill, P.
1
Pederson, D.
1
Rayner, D.
1
Simard, B.
.
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Subject
1
Binding Sites
1
Carbon Monoxide
1
Computer Simulation
1
Models, Chemical
1
Quantum Theory
1
Thermodynamics
1
Transition Elements
Date issued
1
2009
1
2008
1
2007
1
2005
2
2004