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- Currently displaying 501 - 520 of 654 publications
Structural consequences of the range of the interatomic potential - A menagerie of clusters
– Journal of the Chemical Society, Faraday Transactions
(1997)
93,
4233
(doi: 10.1039/a706221d)
Isomerization dynamics and ergodicity in Ar-7
– The Journal of Chemical Physics
(1997)
107,
8568
(doi: 10.1063/1.475008)
Reactions of size-selected positively charged nickel clusters with carbon monoxide in molecular beams
– The Journal of Chemical Physics
(1997)
107,
3492
(doi: 10.1063/1.474688)
Global optimization by basin-hopping and the lowest energy structures of Lennard-Jones clusters containing up to 110 atoms
– The Journal of Physical Chemistry A
(1997)
101,
5111
(doi: 10.1021/jp970984n)
Effects of three-body (Axilrod-Teller) forces on the classical and quantum behavior of rare-gas trimers
– \pre
(1997)
56,
363
(doi: 10.1103/physreve.56.363)
Structural predictions for (C60)N clusters with an all-atom potential
– Chemical Physics Letters
(1997)
269,
408
Theoretical study of the water tetramer
– The Journal of Chemical Physics
(1997)
106,
7193
(doi: 10.1063/1.473681)
Comment on “Relaxation of collective excitations in LJ-13 cluster” [J. Chem. Phys. 105 , 3679 (1996)]
– The Journal of Chemical Physics
(1997)
106,
5296
(doi: 10.1063/1.473994)
Surveying a potential energy surface by eigenvector-following
– Zeitschrift f�r Physik D Atoms, Molecules and Clusters
(1997)
40,
194
(doi: 10.1007/s004600050192)
Thermally-induced surface reconstructions of Mackay icosahedra
– Zeitschrift für Physik D Atoms,Molecules and Clusters
(1997)
40,
466
(doi: 10.1007/s004600050253)
Comparison of reaction pathways calculated by different algorithms for disilane and water trimer
– Zeitschrift für Physik D Atoms,Molecules and Clusters
(1997)
40,
229
(doi: 10.1007/s004600050200)
Fluctuation, relaxation and rearrangement dynamics of a model (H2O)20 cluster: Non-statistical dynamical behavior
– J. Chem. Phys.
(1997)
106,
3329
(doi: 10.1063/1.473081)
Gradient line reaction paths for hindered internal rotation in H2BNH2 and inversion in PF3
– The Journal of Physical Chemistry A
(1997)
101,
1384
(doi: 10.1021/jp9628343)
Structure, dynamics, and thermodynamics of benzene-Ar n clusters (1⩽ n ⩽8 and n =19)
– The Journal of Chemical Physics
(1997)
106,
1530
(doi: 10.1063/1.473301)
Theoretical study of the water tetramer
– J. Chem. Phys.
(1997)
106,
7193-7207
Structure, dynamics, and thermodynamics of benzene-Ar-n clusters (1<=n<=B and n=19)
– J. Chem. Phys.
(1997)
106,
1530-1544
Global optimization by basin-hopping and the lowest energy structures of Lennard-Jones clusters containing up to 110 atoms
– J. Phys. Chem. A
(1997)
101,
5111-5116
Structural predictions for $\rm (C_60)_N$ clusters with an all-atom potential
– Chem. Phys. Lett.
(1997)
269,
408-412
Relaxation of collective excitations in LJ-13 cluster - Comment
– J. Chem. Phys.
(1997)
106,
5296-5296
Isomerization dynamics and ergodicity in Ar-7
– J. Chem. Phys.
(1997)
107,
8568-8574
