Metal-Metal Bonding Trends in Mixed-Group, Face-Shared d 3 d 3 Bioctahedral Dimer Systems, M'M"Cl 9 n-
| dc.contributor.author | Petrie, Simon | |
| dc.contributor.author | Stranger, Robert | |
| dc.date.accessioned | 2015-12-13T23:05:52Z | |
| dc.date.issued | 2002 | |
| dc.date.updated | 2015-12-12T08:02:42Z | |
| dc.description.abstract | The results of density functional theory (DFT) calculations on a set of binuclear nonachloride complexes M′M″Cl94- (M′ = V, Nb, Ta; M″ = Cr, Mo, W) and M′M″Cl92- (M′ = Cr, Mo, W; M″ = Mn, Tc, Re), in which each metal possesses a nominal d3 | |
| dc.identifier.issn | 0277-5387 | |
| dc.identifier.uri | http://hdl.handle.net/1885/85749 | |
| dc.publisher | Pergamon-Elsevier Ltd | |
| dc.source | Polyhedron | |
| dc.subject | Keywords: dimer; metal; acceleration; article; binding affinity; calculation; chemical structure; density; dimerization; electrochemical analysis; electron transport; energy transfer; magnetism; mathematical analysis; metal binding; molecular interaction; polarizat DFT calculations; Dinuclear transition metal complexes; Electron transfer; Magnetic coupling; Metal-metal bonding; Spin polarization | |
| dc.title | Metal-Metal Bonding Trends in Mixed-Group, Face-Shared d 3 d 3 Bioctahedral Dimer Systems, M'M"Cl 9 n- | |
| dc.type | Journal article | |
| local.bibliographicCitation.lastpage | 1175 | |
| local.bibliographicCitation.startpage | 1163 | |
| local.contributor.affiliation | Petrie, Simon, College of Physical and Mathematical Sciences, ANU | |
| local.contributor.affiliation | Stranger, Robert, College of Physical and Mathematical Sciences, ANU | |
| local.contributor.authoruid | Petrie, Simon, u9800071 | |
| local.contributor.authoruid | Stranger, Robert, u8708796 | |
| local.description.embargo | 2037-12-31 | |
| local.description.notes | Imported from ARIES | |
| local.description.refereed | Yes | |
| local.identifier.absfor | 030701 - Quantum Chemistry | |
| local.identifier.ariespublication | MigratedxPub14392 | |
| local.identifier.citationvolume | 21 | |
| local.identifier.doi | 10.1016/S0277-5387(02)00999-3 | |
| local.identifier.scopusID | 2-s2.0-0036603421 | |
| local.type.status | Published Version |