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- Currently displaying 641 - 660 of 700 publications
THEORETICAL-STUDY OF WATER TRIMER
\jacs
(1993)
115
11180-11190
STRUCTURE AND DYNAMICS OF MODEL AG AND PT CLUSTERS
\zpdamc
(1993)
26
258-260
Structures and rearrangements of model silicon clusters
Journal of the Chemical Society, Faraday Transactions
(1992)
88
3409
(doi: 10.1039/ft9928803409)
Systematic investigation of the structures and rearrangements of six-atom clusters bound by a model anisotropic potential
Journal of the Chemical Society Faraday Transactions
(1992)
88
3295
(doi: 10.1039/FT9928803295)
Some further restrictions on the geometries of transition states
Chemical Physics Letters
(1992)
198
279
(doi: 10.1016/0009-2614(92)85051-B)
Simulated transmission electron microscope images and characterisation of concentric shell and icospiral graphitic microparticles
Journal of the Chemical Society, Faraday Transactions
(1992)
88
2815
(doi: 10.1039/FT9928802815)
Structure and energetics of model metal clusters
The Journal of Chemical Physics
(1992)
96
8520
(doi: 10.1063/1.462305)
Spectroscopic signature of fractal excitons
Physical Chemistry Chemical Physics
(1992)
88
1359
(doi: 10.1039/FT9928801359)
When do gradient optimisations converge to saddle points?
Chemical Physics Letters
(1992)
190
447
(doi: 10.1016/0009-2614(92)85171-6)
Basins of attraction for stationary points on a potential-energy surface
Journal of the Chemical Society Faraday Transactions
(1992)
88
653-657
(doi: 10.1039/FT9928800653)
Limitations of the Murrell-Laidler theorem
Physical Chemistry Chemical Physics
(1992)
88
543
(doi: 10.1039/ft9928800543)
SIMULATED TRANSMISSION ELECTRON-MICROSCOPE IMAGES AND CHARACTERIZATION OF CONCENTRIC SHELL AND ICOSPIRAL GRAPHITIC MICROPARTICLES
\jcsft
(1992)
88
2815-2821
SOME FURTHER RESTRICTIONS ON THE GEOMETRIES OF TRANSITION-STATES
Chem. Phys. Lett.
(1992)
198
279-282
SPECTROSCOPIC SIGNATURE OF FRACTAL EXCITONS
\jcsft
(1992)
88
1359-1367
LIMITATIONS OF THE MURRELL-LAIDLER THEOREM
\jcsft
(1992)
88
543-544
STRUCTURE AND ENERGETICS OF MODEL METAL-CLUSTERS
J. Chem. Phys.
(1992)
96
8520-8534
SYSTEMATIC INVESTIGATION OF THE STRUCTURES AND REARRANGEMENTS OF 6- ATOM CLUSTERS BOUND BY A MODEL ANISOTROPIC POTENTIAL
\jcsft
(1992)
88
3295-3304
WHEN DO GRADIENT OPTIMIZATIONS CONVERGE TO SADDLE- POINTS
Chem. Phys. Lett.
(1992)
190
447-452
STRUCTURES AND REARRANGEMENTS OF MODEL SILICON CLUSTERS
\jcsft
(1992)
88
3409-3417
