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  • Currently displaying 521 - 540 of 682 publications
Author(s)
Publication title
Journal Name
Publication year
Structure and properties of Ne-n(+) clusters from a diatomics-in- molecules approach
FY Naumkin, DJ Wales
\molphys
(1998)
93
Thermodynamics and the Global Optimization of Lennard-Jones Clusters
JPK Doye, DJ Wales, MA Miller
J. Chem. Phys.
(1998)
109
Influence of the atom-atom interaction anisotropy on the structure and stability of ArnCl2 clusters
FY Naumkin, DJ Wales
Chem. Phys. Lett.
(1998)
290
Infrared spectra of argon clusters
A Dullweber, DJ Wales
\molphys
(1998)
94
Dynamics and Rearrangements of Water Cluster
DJ Wales
(1998)
3
Global minima for transition metal clusters described by Sutton-Chen potentials
JPK Doye, DJ Wales
New Journal of Chemistry
(1998)
22
Thermodynamics of global optimization
JPK Doye, DJ Wales
\prl
(1998)
80
Small Water Clusters
DJ Wales
(1998)
Structural consequences of the range of the interatomic potential - A menagerie of clusters
JPK Doye, DJ Wales
Journal of the Chemical Society - Faraday Transactions
(1997)
93
Isomerization dynamics and ergodicity in Ar7
MA Miller, DJ Wales
The Journal of Chemical Physics
(1997)
107
Reactions of size-selected positively charged nickel clusters with carbon monoxide in molecular beams
S Vajda, S Wolf, T Leisner, U Busolt, LH Woste, DJ Wales
The Journal of Chemical Physics
(1997)
107
Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms
DJ Wales, JPK Doye
The Journal of Physical Chemistry A
(1997)
101
Effects of three-body (Axilrod-Teller) forces on the classical and quantum behavior of rare-gas trimers
C Chakravarty, RJ Hinde, DM Leitner, DJ Wales
\pre
(1997)
56
Structural predictions for (c60)N clusters with an all-atom potential
JPK Doye, A Dullweber, DJ Wales
Chemical Physics Letters
(1997)
269
Theoretical study of the water tetramer
DJ Wales, TR Walsh
Journal of Chemical Physics
(1997)
106
Comment on “Relaxation of collective excitations in LJ-13 cluster” [J. Chem. Phys. 105, 3679 (1996)]
DJ Wales, JPK Doye
The Journal of Chemical Physics
(1997)
106
Thermally-induced surface reconstructions of Mackay icosahedra
JPK Doye, DJ Wales
Zeitschrift für Physik D Atoms Molecules and Clusters
(1997)
40
Surveying a potential energy surface by eigenvector-following: Applications to global optimisation and the structural transformations of clusters
JPK Doye, DJ Wales
Zeitschrift für Physik D Atoms, Molecules and Clusters
(1997)
40
Comparison of reaction pathways calculated by different algorithms for disilane and water trimer
TR Walsh, DJ Wales
Zeitschrift für Physik D Atoms Molecules and Clusters
(1997)
40
Fluctuation, relaxation and rearrangement dynamics of a model (H2O)(20) cluster: Non-statistical dynamical behavior
A Baba, Y Hirata, S Saito, I Ohmine, DJ Wales
Journal of Chemical Physics
(1997)
106