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- Currently displaying 561 - 580 of 694 publications
Rearrangements and tunneling splittings in small water clusters
RECENT THEORETICAL AND EXPERIMENTAL ADVANCES IN HYDROGEN BONDED CLUSTERS
(1997)
561
201
Reactions of size-selected positively charged nickel clusters with carbon monoxide in molecular beams
J. Chem. Phys.
(1997)
107
3492-3497
Relaxation of collective excitations in LJ-13 cluster - Comment
J. Chem. Phys.
(1997)
106
5296-5296
Gradient line reaction paths for hindered internal rotation in H2BNH2 and inversion in PF3
\jpca
(1997)
101
1384-1392
Structural consequences of the range of the interatomic potential A menagerie of clusters
Physical Chemistry Chemical Physics
(1997)
93
4233
(doi: 10.1039/a706221d)
Rearrangements of bulk face-centred-cubic nickel modelled by a Sutton[ndash ]Chen potential
Faraday Discussions
(1997)
106
409
(doi: 10.1039/a701489i)
The structure of (C-60)(N) clusters
Chemical Physics Letters
(1996)
262
167
(doi: 10.1016/0009-2614(96)01039-1)
On potential energy surfaces and relaxation to the global minimum
The Journal of Chemical Physics
(1996)
105
8428
(doi: 10.1063/1.472697)
Theoretical study of the water pentamer
Journal of Chemical Physics
(1996)
105
6957
(doi: 10.1063/1.471987)
Structure, rearrangements and evaporation of rotating atomic clusters
Molecular Physics
(1996)
89
533-554
(doi: 10.1080/00268979609482492)
Theoretical study of rapid topomerization in tetracyclo[4.4.4.4]-1-bora-3,5-diazapentane
Chemical Physics Letters
(1996)
259
173
(doi: 10.1016/0009-2614(96)00717-8)
Rearrangements of the water trimer
Journal of the Chemical Society Faraday Transactions
(1996)
92
2505
(doi: 10.1039/ft9969202505)
What can calculations employing empirical potentials teach us about bare transition-metal clusters?
Journal of the Chemical Society, Dalton Transactions
(1996)
611
(doi: 10.1039/dt9960000611)
From topographies to dynamics on multidimensional potential energy surfaces of atomic clusters
Science
(1996)
271
963
(doi: 10.1126/science.271.5251.963)
Structure, Dynamics, and Thermodynamics of Clusters: Tales from Topographic Potential Surfaces
Science
(1996)
271
925
(doi: 10.1126/science.271.5251.925)
Changes of morphology and capping of model transition metal clusters
\jpc
(1996)
100
2053
(doi: 10.1021/jp952521s)
The Structure and Stability of Atomic Liquids: From Clusters to Bulk
Science
(1996)
271
484
(doi: 10.1126/science.271.5248.484)
WHAT CAN CALCULATIONS EMPLOYING EMPIRICAL POTENTIALS TEACH US ABOUT BARE TRANSITION-METAL CLUSTERS
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
(1996)
611-623
STRUCTURE, DYNAMICS, AND THERMODYNAMICS OF CLUSTERS - TALES FROM TOPOGRAPHIC POTENTIAL SURFACES
Science
(1996)
271
925-929
Theoretical predictions of structure and thermodynamics in the large cluster regime
(1996)
313
241
(doi: 10.1007/978-94-009-0211-4_9)
