Tips on using this search form

  • All search terms are case-insensitive
  • If you specify more than one search option (e.g. you search for both "Authors" and "Paper title") then the publications returned will be those that match all of your search terms
  • To reset the search form, click here
  • Currently displaying 581 - 600 of 700 publications
Author(s)
Publication title
Journal Name
Publication year
Changes of morphology and capping of model transition metal clusters
DJ Wales, LJ Munro
Journal of Physical Chemistry
(1996)
100
The Structure and Stability of Atomic Liquids: From Clusters to Bulk
JPK Doye, DJ Wales
Science
(1996)
271
ON POTENTIAL-ENERGY SURFACES AND RELAXATION TO THE GLOBAL MINIMUM
JPK Doye, DJ Wales
J. Chem. Phys.
(1996)
105
THE STRUCTURE AND STABILITY OF ATOMIC LIQUIDS - FROM CLUSTERS TO BULK
JPK Doye, DJ Wales
Science
(1996)
271
STRUCTURE, DYNAMICS, AND THERMODYNAMICS OF CLUSTERS - TALES FROM TOPOGRAPHIC POTENTIAL SURFACES
DJ Wales
Science
(1996)
271
WHAT CAN CALCULATIONS EMPLOYING EMPIRICAL POTENTIALS TEACH US ABOUT BARE TRANSITION-METAL CLUSTERS
DJ Wales, LJ Munro, JPK Doye
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
(1996)
REARRANGEMENTS OF THE WATER TRIMER
TR Walsh, DJ Wales
Journal of the Chemical Society, Faraday Transactions
(1996)
92
THE EFFECT OF THE RANGE OF THE POTENTIAL ON THE STRUCTURE AND STABILITY OF SIMPLE LIQUIDS - FROM CLUSTERS TO BULK, FROM SODIUM TO C-60
JPK Doye, DJ Wales
J. Phys. B
(1996)
29
Theoretical predictions of structure and thermodynamics in the large cluster regime
DJ Wales, JPK Doye
(1996)
313
THEORETICAL-STUDY OF THE WATER pentamer
DJ Wales, TR Walsh
J. Chem. Phys.
(1996)
105
THEORETICAL-STUDY OF RAPID TOPOMERIZATION IN TETRACYCLO[4.4.4.4]-1- BORA-3,5-DIAZAPENTANE
RM Minyaev, VI Minkin, DJ Wales
Chem. Phys. Lett.
(1996)
259
THE STRUCTURE OF $(C_60)_N$ CLUSTERS
JPK Doye, DJ Wales
Chem. Phys. Lett.
(1996)
262
Magic numbers and growth sequences of small face-centered-cubic and decahedral clusters
J Doye
Chemical Physics Letters
(1995)
247
Magic numbers and growth sequences of small face-centred-cubic and decahedral clusters
J Doye
Chem. Phys. Lett.
(1995)
247
The effect of the range of the potential on the structures of clusters
JPK Doye, DJ Wales, RS Berry
Journal of Chemical Physics
(1995)
103
Coexistence and phase separation in clusters: From the small to the not-so-small regime
DJ Wales, JPK Doye
The Journal of Chemical Physics
(1995)
103
Gradient paths of the reactions of electrophilic addition of HF to ethylene and 1,2 H-shift in H2PN
RM Minyaev, DJ Wales
Journal of Structural Chemistry
(1995)
36
Potential energy surfaces of several van der Waals complexes modelled using distributed multipoles
DJ Wales, AJ Stone, PLA Popelier
Chemical Physics Letters
(1995)
240
An order parameter approach to coexistence in atomic clusters
JPK Doye, DJ Wales
The Journal of Chemical Physics
(1995)
102
Calculation of thermodynamic properties of small Lennard-Jones clusters incorporating anharmonicity
JPK Doye, DJ Wales
J. Chem. Phys.
(1995)
102

Upcoming Events

Energy Landscapes 2026 Telluride

Click on an image to view animations from Energy Landscapes of Model Knotted Polymers, Journal of Chemical Theory and Computation, Tongfan Hao, Yinghao Ge, Mark A. Miller, Agustin L. N. Francesco, David J. Wales, DOI 10.1021/acs.jctc.5c01005

composite knot

link knot