Browsing by Author Petrie, Simon
Showing results 29 to 48 of 69
Location of Potential Substrate Water Binding Sites in the Water Oxidizing Complex of Photosystem II
Author(s) | Petrie, Simon; Stranger, Robert; Pace, Ronald |
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Type | Journal article |
Date Published | 2010 |
Date Created | - |
Magnesium Monocationic Complexes: A Theoretical Study of Metal Ion Binding Energies and Gas-Phase Association Kinetics
Author(s) | Dunbar, Robert C.; Petrie, Simon |
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Type | Journal article |
Date Published | 2005 |
Date Created | - |
Magnesium- and calcium- containing molecular dications: a high level theoretical study
Author(s) | Petrie, Simon; Radom, Leo |
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Type | Journal article |
Date Published | 1999 |
Date Created | - |
Magnetic Coupling and Intermetallic Electron Transfer in the Heterodinuclear Bioctahedral Complexes MW III Cl 9 n- (M = V II , Cr III , Mn IV ): Tweaking the Balance between Ferromagnetism and Antiferromagnetism
Author(s) | Petrie, Simon; Stranger, Robert |
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Type | Journal article |
Date Published | 2002 |
Date Created | - |
Metal-Metal Bonding Trends in Mixed-Group, Face-Shared d 3 d 3 Bioctahedral Dimer Systems, M'M"Cl 9 n-
Author(s) | Petrie, Simon; Stranger, Robert |
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Type | Journal article |
Date Published | 2002 |
Date Created | - |
Mixed-metal cluster chemistry. 19. Crystallographic, spectroscopic, electrochemical, spectroelectrochemical, and theoretical studies of systematically varied tetrahedral group 6-iridium clusters
Author(s) | Lucas, Nigel; Blitz, Jonathan; Petrie, Simon, et al |
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Type | Journal article |
Date Published | 2002 |
Date Created | - |
Mixed-Metal Cluster Chemistry. 22. Synthesis and Crystallographic, Electrochemical, and Theoretical Studies of Alkyne-Coordinated Group 6-Iridium Clusters Linked by Phenyleneethynylene Groups
Author(s) | Lucas, Nigel; Notaras, Eleni; Petrie, Simon, et al |
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Type | Journal article |
Date Published | 2003 |
Date Created | - |
Mixed-metal cluster chemistry. 26. Proclivity for "all-terminal" or "plane-of-bridging-carbonyls" ligand disposition in tungsten-triiridium clusters
Author(s) | Usher, Alistair; Dalton, Gulliver; Lucas, Nigel, et al |
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Type | Journal article |
Date Published | 2004 |
Date Created | - |
Mixed-Metal Cluster Chemistry. 29. Core Expansion and Ligand-Driven Metal Exchange at Group 6-Iridium Clusters
Author(s) | Usher, Alistair; Lucas, Nigel; Dalton, Gulliver, et al |
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Type | Journal article |
Date Published | 2006 |
Date Created | - |
Model Chemistry Methods for Molecular Dications: The Magnesium Dication Affinity Scale
Author(s) | Petrie, Simon |
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Type | Journal article |
Date Published | 2002 |
Date Created | - |
Modelling the metal atom positions of the Photosystem II water oxidising complex: a density functional theory appraisal of the 1.9 Å resolution crystal structure
Author(s) | Petrie, Simon; Gatt, Phillip; Stranger, Robert, et al |
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Type | Journal article |
Date Published | 2012 |
Date Created | - |
Multistate Redox-Active Metalated Triarylamines
Author(s) | Grelaud, Guillaume; Cifuentes, Marie; Schwich, Torsten, et al |
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Type | Journal article |
Date Published | 2012 |
Date Created | - |
NCCN and NCCCCN Formation in Titans Atmosphere: 1. Competing Reactions of Precursor HCCN ( 3 A) with H ( 2 S) and CH 3 ( 2 A)
Author(s) | Osamura, Yoshihiro; Petrie, Simon |
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Type | Journal article |
Date Published | 2004 |
Date Created | - |
NCCN and NCCCCN Formation in Titans Atmosphere: 2. HNC as a viable Precursor
Author(s) | Petrie, Simon; Osamura, Yoshihiro |
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Type | Journal article |
Date Published | 2004 |
Date Created | - |
NCCN in TMC-1 and IRC+10216
Author(s) | Petrie, Simon; Millar, T; Markwick, A |
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Type | Journal article |
Date Published | 2003 |
Date Created | - |
On the Mechanism of Dioxygen Formation from a Di-m-Oxo-Bridged Manganese Dinuclear Complex
Author(s) | Petrie, Simon; Stranger, Robert |
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Type | Journal article |
Date Published | 2004 |
Date Created | - |
Organometallic complexes for nonlinear optics. 42. Syntheses, linear, and nonlinear optical properties of ligated metal-functionalized oligo(p-phenyleneethynylene)s
Author(s) | Dalton, Gulliver; Cifuentes, Marie; Watson, Laurance, et al |
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Type | Journal article |
Date Published | 2009 |
Date Created | - |
Organometallic Complexes for Nonlinear Optics. 43. Quadratic Optical Nonlinearities of Dipolar Alkynylruthenium Complexes with Phenyleneethynylene/Phenylenevinylene Bridges
Author(s) | Rigamonti, Luca; Babgi, Bandar; Cifuentes, Marie, et al |
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Type | Journal article |
Date Published | 2009 |
Date Created | - |
Products of meteoric metal ion chemistry within planetary atmospheres. 1. Mg + at Titan
Author(s) | Petrie, Simon |
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Type | Journal article |
Date Published | 2004 |
Date Created | - |
Proton-transport catalysis and proton-abstraction reactions: An ab initio dynamical study of X+HOC[sup +] and XH[sup +]+CO (X=Ne, Ar, and Kr)
Author(s) | Collins, Michael A.; Petrie, Simon; Chalk, Andrew, et al |
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Type | Journal article |
Date Published | 15-Apr-2000 |
Date Created | - |
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