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  • Currently displaying 641 - 660 of 694 publications
Author(s)
Publication title
Journal Name
Publication year
Some further restrictions on the geometries of transition states
DJ Wales, AM Lee
Chemical Physics Letters
(1992)
198
Structure and energetics of model metal clusters
J Uppenbrink, DJ Wales
Journal of Chemical Physics
(1992)
96
When do gradient optimisations converge to saddle points?
J Uppenbrink, DJ Wales
Chemical Physics Letters
(1992)
190
Chaos in small clusters of inert gas atoms
RJ Hinde, RS Berry, DJ Wales
The Journal of Chemical Physics
(1992)
96
WHEN DO GRADIENT OPTIMIZATIONS CONVERGE TO SADDLE- POINTS
J Uppenbrink, DJ Wales
Chem. Phys. Lett.
(1992)
190
STRUCTURE AND ENERGETICS OF MODEL METAL-CLUSTERS
J Uppenbrink, DJ Wales
J. Chem. Phys.
(1992)
96
SYSTEMATIC INVESTIGATION OF THE STRUCTURES AND REARRANGEMENTS OF 6- ATOM CLUSTERS BOUND BY A MODEL ANISOTROPIC POTENTIAL
JPK Doye, DJ Wales
\jcsft
(1992)
88
SIMULATED TRANSMISSION ELECTRON-MICROSCOPE IMAGES AND CHARACTERIZATION OF CONCENTRIC SHELL AND ICOSPIRAL GRAPHITIC MICROPARTICLES
KG Mckay, HW Kroto, DJ Wales
\jcsft
(1992)
88
LIMITATIONS OF THE MURRELL-LAIDLER THEOREM
DJ Wales, RS Berry
\jcsft
(1992)
88
Limitations of the Murrell-Laidler theorem
DJ Wales, RS Berry
J. Chem. Soc., Faraday Trans.
(1992)
88
STRUCTURES AND REARRANGEMENTS OF MODEL SILICON CLUSTERS
DJ Wales, MC Waterworth
\jcsft
(1992)
88
SOME FURTHER RESTRICTIONS ON THE GEOMETRIES OF TRANSITION-STATES
DJ Wales, AM Lee
Chem. Phys. Lett.
(1992)
198
SPECTROSCOPIC SIGNATURE OF FRACTAL EXCITONS
DJ Wales, GE Ewing
\jcsft
(1992)
88
STRUCTURE AND ENERGETICS OF MODEL SYMMETRICAL AND ASYMMETRIC DECAHEDRA
J Uppenbrink, DJ Wales, AI Kirkland, DA Jefferson, J Urban
Phil. Mag. B
(1992)
65
Instantaneous normal mode analysis and coexistence phenomena in small clusters
DJ Wales
Journal of the Chemical Society Faraday Transactions
(1991)
87
Packing schemes for Lennard-Jones clusters of 13 to 150 atoms: Minima, transition states and rearrangement mechanisms
J Uppenbrink, DJ Wales
Physical Chemistry Chemical Physics
(1991)
87
Stable configurations of confined cold ionic systems.
R Rafac, JP Schiffer, JS Hangst, DH Dubin, DJ Wales
Proceedings of the National Academy of Sciences
(1991)
88
Theoretical study of some small van der waals complexes containing inert gas atoms
DJ Wales
Molecular Physics
(1991)
74
LOCAL INTERPRETATION OF CHAOTIC DYNAMICS IN A MANY-BODY CLASSICAL HAMILTONIAN SYSTEM
DJ Wales, RS Berry
J. Phys. B
(1991)
24
Calculating the rate of loss of information from chaotic time series by forecasting
DJ Wales
Nature
(1991)
350

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