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  • Currently displaying 24641 - 24660 of 31130 publications
Author(s)
Publication title
Journal Name
Publication year
The oxygen scavenging properties of alkali metal-containing organometallic compounds
AEH Wheatley
Chemical Society Reviews
(2001)
30
Glyoxal studied with 'Multimode', explicit large amplitude motion and anharmonicity
DP Tew, NC Handy, S Carter
Physical Chemistry Chemical Physics
(2001)
3
Adsorption behaviour of the binary mixtures of octane and nonane at sub-monolayer coverage on graphite
M Castro, SM Clarke, A Inaba, RK Thomas, T Arnold
Physical Chemistry Chemical Physics
(2001)
3
A Double Ring Closing Metathesis Reaction in the Rapid, Enantioselective Synthesis of NK-1 Receptor Antagonists
DJ Wallace, JM Goodman, DJ Kennedy, AJ Davies, CJ Cowden, MS Ashwood, IF Cottrell, UH Dolling, PJ Reider
Org Lett
(2001)
3
A density functional theory study of hydroxyl and the intermediate in the water formation reaction on Pt
A Michaelides, P Hu
The Journal of Chemical Physics
(2001)
114
A Monte Carlo study of symmetry breaking of I3- in aqueous solution using a multistate diabatic Hamiltonian
CJ Margulis, DF Coker, RM Lynden-Bell
The Journal of Chemical Physics
(2001)
114
The scope and limitation of the [1,4]-Sbenzyl participation and debenzylation in the stereochemically controlled synthesis of substituted thiolanes
J Eames, N Kuhnert, S Warren
Journal of the Chemical Society, Perkin Transactions 1
(2001)
The effects of distal ligand substitution on the copper(II)/bis-(2,6-dipyrazol-1-ylpyridine) centre†
NK Solanki, MA Leech, EJL McInnes, JP Zhao, FE Mabbs, N Feeder, JAK Howard, JE Davies, JM Rawson, MA Halcrow
Dalton Transactions
(2001)
The kinetic profile of phthalazinium-2-dicyanomethanide 1,3-dipole with 2π-dipolarophiles: U-shaped dipolarophilic activity and classic type II dipole behaviour. Reaction rates and DFT calculations
RN Butler, AG Coyne, LA Burke
Journal of the Chemical Society Perkin Transactions 2
(2001)
1
Rate constants and Arrhenius parameters for the reactions of OH radicals and Cl atoms with CF3CH2OCHF2, CF3CHClOCHF2 and CF3CH2OCClF2, using the discharge-flow/resonance fluorescence method
SD Beach, KM Hickson, IWM Smith, RP Tuckett
Physical Chemistry Chemical Physics
(2001)
3
Electrostatic potential inside ionic solutions confined by dielectrics: a variational approach
R Allen, J-P Hansen, S Melchionna
Physical Chemistry Chemical Physics
(2001)
3
Modeling the ozone layer: A perspective on the northern hemisphere
J Pyle, MP Chipperfield, M Guirlet
Ozone Science and Engineering
(2001)
23
Changes in global stratospheric ozone
NRP Harris, L Bishop
Ozone Science and Engineering
(2001)
23
Energy Landscapes
DJ Wales
(2001)
Les Houches Session LXXIII
ENERGY LANDSCAPES: Flirting with Catastrophe
RH Leary
Sci.
(2001)
293
Taking a Walk on a Landscape
CL Brooks, JN Onuchic, DJ Wales
Science
(2001)
293
Polytetrahedral Clusters
JPK Doye, DJ Wales
Phys. Rev. Lett.
(2001)
86
Quantum partition functions from classical distributions: Application to rare-gas clusters
F Calvo, JPK Doye, DJ Wales
J. Chem. Phys.
(2001)
114
Transition States and Rearrangement Mechanisms from Hybrid Eigenvector-Following and Density Functional Theory. Application to C10H10 and Defect Migration in Crystalline Silicon
Y Kumeda, LJ Munro, DJ Wales
Chem. Phys. Lett.
(2001)
341
Identification of Tyr58 as the proton donor in the aspartate-α-decarboxylase reaction
SA Saldanha, LM Birch, ME Webb, BK Nabbs, F von Delft, AG Smith, C Abell
Chemical Communications
(2001)
1