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Articles in Scholarly Journals [Incomplete List]

1. Thermodynamics and Kinetics of Aggregation for the GNNQQNY Peptide
   Journal of the American Chemical Society, vol. 129, no. 51, pp. 16005–16014, 2007
2. Comparison of double-ended transition state search methods
   The Journal of Chemical Physics, vol. 127, no. 13, p. 134102, 2007
3. Geometry optimization for peptides and proteins: Comparison of Cartesian and internal coordinates
   The Journal of Chemical Physics, vol. 127, no. 23, p. 234105, 2007
4. Theory of C[sub 2]H[sub x] species on Pt{110} (1×2): Reaction pathways for dehydrogenation
   The Journal of Chemical Physics, vol. 126, no. 4, p. 044710, 2007
5. Equilibrium density of states and thermodynamic properties of a model glass former
   The Journal of Chemical Physics, vol. 127, no. 4, p. 044508, 2007
6. Energy landscapes for water clusters in a uniform electric field
   The Journal of Chemical Physics, vol. 126, no. 5, p. 054506, 2007
7. Helix Self-Assembly from Anisotropic Molecules
   Physical Review Letters, vol. 99, no. 8, 2007
8. Geometric magic numbers of sodium clusters: Interpretation of the melting behaviour
   The European Physical Journal D, vol. 43, no. 1-3, pp. 57–60, 2007
9. Structure and dynamics of spherical crystals characterized for the Thomson problem
   Physical Review B, vol. 74, no. 21, 2006
10. Super-Arrhenius Diffusion in an Undercooled Binary Lennard-Jones Liquid Results from a Quantifiable Correlation Effect
    Physical Review Letters, vol. 96, no. 5, 2006
11. Correlation effects and super-Arrhenius diffusion in binary Lennard-Jones mixtures
    Physical Review B, vol. 74, no. 13, 2006
12. Equilibrium thermodynamics from basin-sampling
    The Journal of Chemical Physics, vol. 124, no. 4, p. 044102, 2006
13. Graph transformation method for calculating waiting times in Markov chains
    The Journal of Chemical Physics, vol. 124, no. 23, p. 234110, 2006
14. Thermodynamics of water octamer in a uniform electric field
    The Journal of Chemical Physics, vol. 125, no. 22, p. 224302, 2006
15. Energy landscapes: calculating pathways and rates
    International Reviews in Physical Chemistry, vol. 25, no. 1-2, pp. 237–282, 2006
16. Kinetic analysis of discrete path sampling stationary point databases
    Molecular Physics, vol. 104, no. 9, pp. 1497–1507, 2006
17. The Journal of Physical Chemistry B, vol. 110, no. 9, pp. 4147–4156, 2006
18. Journal of Physical Chemistry B, vol. 110, no. 27, pp. 13357–13362, 2006
19. Journal of Physical Chemistry B, vol. 110, no. 42, pp. 20765–20776, 2006
20. Finding pathways between distant local minima
    The Journal of Chemical Physics, vol. 122, no. 23, p. 234903, 2005
21. Pathways for dissociative ethane chemisorption on Pt 110 (1×2) using density functional theory
    Chemical Physics Letters, vol. 413, no. 4-6, pp. 289–293, 2005
22. Global minima and energetics of Li(HO) and Ca(HO) clusters for ?20
    Chemical Physics Letters, vol. 412, no. 1-3, pp. 23–28, 2005
23. The Journal of Physical Chemistry A, vol. 109, no. 11, pp. 2487–2497, 2005
24. The Journal of Physical Chemistry B, vol. 109, no. 49, pp. 23109–23112, 2005
25. Global minima for water clusters (HO), ?21, described by a five-site empirical potential
    Chemical Physics Letters, vol. 415, no. 4-6, pp. 302–307, 2005
26. Global minima of (C)Ca, (C)F and (C)I clusters
    Chemical Physics Letters, vol. 410, no. 4-6, pp. 404–409, 2005
27. Protonated water clusters described by an empirical valence bond potential
    The Journal of Chemical Physics, vol. 122, no. 13, p. 134306, 2005
28. Energy landscapes and properties of biomolecules
    Physical Biology, vol. 2, no. 4, pp. S86–S93, 2005
29. Influence of vibrational energy flow on isomerization of flexible molecules: Incorporating non-Rice-Ramsperger-Kassel-Marcus kinetics in the simulation of dipeptide isomerization
    The Journal of Chemical Physics, vol. 123, no. 12, p. 124304, 2005
30. Diagnosing broken ergodicity using an energy fluctuation metric
    The Journal of Chemical Physics, vol. 123, no. 13, p. 134504, 2005
31. An ab initio study of tunneling splittings in the water trimer
    The Journal of Chemical Physics, vol. 123, no. 4, p. 044302, 2005
32. Archetypal energy landscapes: Dynamical diagnosis
    The Journal of Chemical Physics, vol. 122, no. 2, p. 024103, 2005
33. Global optimization and folding pathways of selected a-helical proteins
    The Journal of Chemical Physics, vol. 123, no. 23, p. 234901, 2005
34. How many dimensions are required to approximate the potential energy landscape of a model protein?
    The Journal of Chemical Physics, vol. 122, no. 8, p. 084714, 2005
35. Pathways for dissociative methane chemisorption on Pt{110}-(1×2)
    Physical Review B, vol. 71, no. 11, 2005
36. The energy landscape as a unifying theme in molecular science
    Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences, vol. 363, no. 1827, pp. 357–377, 2005
37. International Journal of Modern Physics B [Condensed Matter Physics; Statistical Physics; Applied Physics], vol. 19, no. 15 & 17, p. 2877, 2005
38. Energy landscapes, self-assembly and viruses
    Journal of Theoretical Medicine, vol. 6, no. 2, pp. 107–110, 2005
39. Symmetry and density functionals
    Molecular Physics, vol. 103, no. 2-3, pp. 269–271, 2005
40. Finite-size effects in the dynamics and thermodynamics of two-dimensional Coulomb clusters
    Physical Review E, vol. 72, no. 2, 2005
41. Some further applications of discrete path sampling to cluster isomerization
    Molecular Physics, vol. 102, no. 9-10, pp. 891–908, 2004
42. A doubly nudged elastic band method for finding transition states
    The Journal of Chemical Physics, vol. 120, no. 5, p. 2082, 2004
43. New results for phase transitions from catastrophe theory
    The Journal of Chemical Physics, vol. 120, no. 23, p. 11090, 2004
44. Folding of the GB1 hairpin peptide from discrete path sampling
    The Journal of Chemical Physics, vol. 121, no. 2, p. 1080, 2004
45. Effect of salt bridges on the energy landscape of a model protein
    The Journal of Chemical Physics, vol. 121, no. 20, p. 10284, 2004
46. An ab initio study of tunneling splittings in the water dimer
    The Journal of Chemical Physics, vol. 120, no. 13, p. 5993, 2004
47. Erratum: A doubly nudged elastic band method for finding transition states [J. Chem. Phys. 120, 2082 (2004)]
    The Journal of Chemical Physics, vol. 120, no. 16, p. 7820, 2004
48. Comparison of kinetic Monte Carlo and molecular dynamics simulations of diffusion in a model glass former
    The Journal of Chemical Physics, vol. 120, no. 17, p. 8134, 2004
49. Supercooled Lennard-Jones liquids and glasses: a kinetic Monte Carlo approach*1
    Journal of Non-Crystalline Solids, vol. 336, no. 3, pp. 218–222, 2004
50. The dynamics of conformational isomerization in flexible biomolecules. II. Simulating isomerizations in a supersonic free jet with master equation dynamics
    The Journal of Chemical Physics, vol. 120, no. 1, p. 148, 2004
51. Analysis of cooperativity and localization for atomic rearrangements
    The Journal of Chemical Physics, vol. 121, no. 14, p. 6689, 2004
52. Lowest-energy structures of (C[sub 60])[sub n]X (X=Li[sup +],Na[sup +],K[sup +],Cl[sup -]) and (C[sub 60])[sub n]YCl (Y=Li,Na,K) clusters for n=13
    The Journal of Chemical Physics, vol. 121, no. 24, p. 12315, 2004
53. Theoretical study of finite-temperature spectroscopy in van der Waals clusters. II. Time-dependent absorption spectra
    The Journal of Chemical Physics, vol. 118, no. 19, p. 8754, 2003
54. The free energy landscape and dynamics of met-enkephalin
    The Journal of Chemical Physics, vol. 119, no. 18, p. 9947, 2003
55. The favored cluster structures of model glass formers
    The Journal of Chemical Physics, vol. 118, no. 6, p. 2792, 2003
56. Free energy landscapes of model peptides and proteins
    The Journal of Chemical Physics, vol. 118, no. 8, p. 3891, 2003
57. Comment on “Quasisaddles as relevant points of the potential energy surface in the dynamics of supercooled liquids” [J. Chem. Phys. 116, 10297 (2002)]
    The Journal of Chemical Physics, vol. 118, no. 11, p. 5263, 2003
58. Stationary points and dynamics in high-dimensional systems
    The Journal of Chemical Physics, vol. 119, no. 23, p. 12409, 2003
59. Ab initio study of rearrangements between C60 fullerenes
    Chemical Physics Letters, vol. 374, no. 1-2, pp. 125–131, 2003
60. Global minima for rare gas clusters containing one alkali metal ion
    The Journal of Chemical Physics, vol. 119, no. 15, p. 7800, 2003
61. Energy landscapes of model glasses. II. Results for constant pressure
    The Journal of Chemical Physics, vol. 118, no. 10, p. 4583, 2003
62. Density effects in a bulk binary Lennard-Jones system
    Physical Review B, vol. 68, no. 14, 2003
63. Discrete path sampling
    Molecular Physics, vol. 100, no. 20, pp. 3285–3305, 2002
64. Theoretical study of rearrangements in water dimer and trimer
    Molecular Physics, vol. 100, no. 17, pp. 2793–2806, 2002
65. Collapse of Lennard-Jones homopolymers: Size effects and energy landscapes
    The Journal of Chemical Physics, vol. 116, no. 6, p. 2642, 2002
66. Saddle points and dynamics of Lennard-Jones clusters, solids, and supercooled liquids
    The Journal of Chemical Physics, vol. 116, no. 9, p. 3777, 2002
67. The infrared and ultraviolet spectra of single conformations of methyl-capped dipeptides: N-acetyl tryptophan amide and N-acetyl tryptophan methyl amide
    The Journal of Chemical Physics, vol. 117, no. 23, p. 10688, 2002
68. Equilibrium properties of clusters in the harmonic superposition approximation
    Chemical Physics Letters, vol. 366, no. 1-2, pp. 176–183, 2002
69. Diatomics-in-molecules potentials incorporating ab initio data: Application to ionic, Rydberg-excited, and molecule-doped rare gas clusters
    Computer Physics Communications, vol. 145, no. 1, pp. 141–155, 2002
70. Multireference perturbation study of ClF4+
    Physical Chemistry Chemical Physics, vol. 4, no. 10, pp. 1722–1724, 2002
71. Energy landscapes of model polyalanines
    The Journal of Chemical Physics, vol. 117, no. 3, p. 1363, 2002
72. Bifurcation tunneling dynamics in the water trimer
    The Journal of Chemical Physics, vol. 117, no. 19, p. 8823, 2002
73. Quantum partition functions from classical distributions: Application to rare-gas clusters
    The Journal of Chemical Physics, vol. 114, no. 17, p. 7312, 2001
74. Energy landscapes, global optimization and dynamics of the polyalanine Ac(ala)[sub 8]NHMe
    The Journal of Chemical Physics, vol. 114, no. 14, p. 6443, 2001
75. Characterization of anharmonicities on complex potential energy surfaces: Perturbation theory and simulation
    The Journal of Chemical Physics, vol. 115, no. 21, p. 9627, 2001
76. Global optimization and the energy landscapes of Dzugutov clusters
    Faraday Discussions, vol. 118, pp. 159–170, 2001
77. Transition states and rearrangement mechanisms from hybrid eigenvector-following and density functional theory. Application to C10H10 and defect migration in crystalline silicon
    Chemical Physics Letters, vol. 341, no. 1-2, pp. 185–194, 2001
78. Modeling the structure of clusters of C_{60} molecules
    Physical Review B, vol. 64, no. 23, 2001
79. Polytetrahedral Clusters
    Physical Review Letters, vol. 86, no. 25, pp. 5719–5722, 2001
80. Crystals of binary Lennard-Jones solids
    Physical Review B, vol. 64, no. 18, 2001
81. Energy landscapes of some model glass formers
    Physical Review B, vol. 64, no. 2, 2001
82. STATISTICAL THERMODYNAMICS: Taking a Walk on a Landscape
    Science, vol. 293, no. 5530, pp. 612–613, 2001
83. A Microscopic Basis for the Global Appearance of Energy Landscapes
    Science, vol. 293, no. 5537, pp. 2067–2070, 2001
84. Dynamics and thermodynamics of supercooled liquids and glasses from a model energy landscape
    Physical Review B, vol. 63, no. 21, 2001
85. Global minima of protonated water clusters
    Chemical Physics Letters, vol. 324, no. 4, pp. 279–288, 2000
86. Potential energy surfaces and coordinate dependence
    The Journal of Chemical Physics, vol. 113, no. 9, p. 3926, 2000
87. Molecule-doped rare gas clusters: structure and stability of Ar n NO(X 2 Pi 1/2, 3/2 ), n is less than or equal to 25, from new ab initio potential energy surfaces of ArNO
    Molecular Physics, vol. 98, no. 4, pp. 219–229, 2000
88. Structural relaxation in Morse clusters: Energy landscapes
    The Journal of Chemical Physics, vol. 110, no. 1, p. 328, 1999
89. The double-funnel energy landscape of the 38-atom Lennard-Jones cluster
    The Journal of Chemical Physics, vol. 110, no. 14, p. 6896, 1999
90. Rearrangements and tunneling splittings of protonated water dimer
    The Journal of Chemical Physics, vol. 110, no. 21, p. 10403, 1999
91. Defect migration in crystalline silicon
    Physical Review B, vol. 59, no. 6, pp. 3969–3980, 1999
92. Evolution of the potential energy surface with size for Lennard-Jones clusters
    The Journal of Chemical Physics, vol. 111, no. 18, p. 8417, 1999
93. The dynamics of structural transitions in sodium chloride clusters
    The Journal of Chemical Physics, vol. 111, no. 24, p. 11070, 1999
94. Rydberg excitations in rare gas clusters: structure and electronic spectra of Arn (3<n<25)
    Molecular Physics, vol. 96, no. 9, pp. 1295–1304, 1999
95. Energy landscape of a model protein
    The Journal of Chemical Physics, vol. 111, no. 14, p. 6610, 1999
96. Global Optimization of Clusters, Crystals, and Biomolecules
    Science, vol. 285, no. 5432, pp. 1368–1372, 1999
97. Structural relaxation in atomic clusters: Master equation dynamics
    Physical Review E, vol. 60, no. 4, pp. 3701–3718, 1999
98. Rearrangements and tunneling splittings of protonated water trimer
    The Journal of Chemical Physics, vol. 111, no. 18, p. 8429, 1999
99. Structural transitions and global minima of sodium chloride clusters
    Physical Review B, vol. 59, no. 3, pp. 2292–2300, 1999
100. Thermodynamics of Global Optimization
     Physical Review Letters, vol. 80, no. 7, pp. 1357–1360, 1998
101. Nature, vol. 394, no. 6695, pp. 758–760, 1998
102. Relaxation dynamics of C[sub 60]
     The Journal of Chemical Physics, vol. 109, no. 16, p. 6691, 1998
103. Thermodynamics and the global optimization of Lennard-Jones clusters
     The Journal of Chemical Physics, vol. 109, no. 19, p. 8143, 1998
104. Infrared spectra of argon clusters
     Molecular Physics, vol. 94, no. 4, pp. 651–657, 1998
105. Structure and properties of Ne+n clusters from a diatomics-in- molecules approach
     Molecular Physics, vol. 93, no. 4, pp. 633–648, 1998
106. Global minima for transition metal clusters described by Sutton–Chen potentials
     New Journal of Chemistry, vol. 22, no. 7, pp. 733–744, 1998
107. Symmetry, near-symmetry and energetics
     Chemical Physics Letters, vol. 285, no. 5-6, pp. 330–336, 1998
108. Global minima of water clusters (HO), =21, described by an empirical potential
     Chemical Physics Letters, vol. 286, no. 1-2, pp. 65–72, 1998
109. Influence of the atom–atom interaction anisotropy on the structure and stability of Ar?Cl? clusters
     Chemical Physics Letters, vol. 290, no. 1-3, pp. 164–170, 1998
110. Thermally-induced surface reconstructions of Mackay icosahedra
     Zeitschrift f�r Physik D Atoms, Molecules and Clusters, vol. 40, no. 1-4, pp. 466–468, 1997
111. Structural predictions for (C60)N clusters with an all-atom potential
     Chemical Physics Letters, vol. 269, no. 5-6, pp. 408–412, 1997
112. Comparison of reaction pathways calculated by different algorithms for disilane and water trimer
     Zeitschrift für Physik D Atoms, Molecules and Clusters, vol. 40, no. 1, p. 229, 1997
113. Surveying a potential energy surface by eigenvector-following Applications to global optimisation and the structural transformations of clusters
     Zeitschrift f�r Physik D Atoms, Molecules and Clusters, vol. 40, no. 1-4, pp. 194–197, 1997
114. Rearrangements of bulk face-centred-cubic nickel modelled by a Sutton[ndash ]Chen potential
     Faraday Discussions, vol. 106, pp. 409–423, 1997
115. Structural consequences of the range of the interatomic potential A menagerie of clusters
     Journal of the Chemical Society, Faraday Transactions, vol. 93, no. 24, pp. 4233–4243, 1997
116. The Journal of Physical Chemistry A, vol. 101, no. 7, pp. 1384–1392, 1997
117. Reactions of size-selected positively charged nickel clusters with carbon monoxide in molecular beams
     The Journal of Chemical Physics, vol. 107, no. 9, p. 3492, 1997
118. The Journal of Physical Chemistry A, vol. 101, no. 28, pp. 5111–5116, 1997
119. Isomerization dynamics and ergodicity in Ar[sub 7]
     The Journal of Chemical Physics, vol. 107, no. 20, p. 8568, 1997
120. Fluctuation, relaxation and rearrangement dynamics of a model (H2O)20 cluster: Non-statistical dynamical behavior
     The Journal of Chemical Physics, vol. 106, no. 8, p. 3329, 1997
121. Structure, dynamics, and thermodynamics of benzene-Arn clusters (1=n=8 and n=19)
     The Journal of Chemical Physics, vol. 106, no. 4, p. 1530, 1997
122. Theoretical study of the water tetramer
     The Journal of Chemical Physics, vol. 106, no. 17, p. 7193, 1997
123. Effects of three-body (Axilrod-Teller) forces on the classical and quantum behavior of rare-gas trimers
     Physical Review E, vol. 56, no. 1, pp. 363–377, 1997
124. Structure, rearrangements and evaporation of rotating atomic clusters
     Molecular Physics, vol. 89, no. 2, pp. 533–554, 1996
125. Journal of Physics B: Atomic, Molecular and Optical Physics, vol. 29, no. 21, pp. 4859–4894, 1996
126. On potential energy surfaces and relaxation to the global minimum
     The Journal of Chemical Physics, vol. 105, no. 18, p. 8428, 1996
127. Theoretical study of the water pentamer
     The Journal of Chemical Physics, vol. 105, no. 16, p. 6957, 1996
128. The Journal of Physical Chemistry, vol. 100, no. 6, pp. 2053–2061, 1996
129. Rearrangements of the water trimer
     Journal of the Chemical Society, Faraday Transactions, vol. 92, no. 14, p. 2505, 1996
130. Theoretical study of rapid topomerization in tetracyclo[4.4.4.4]-1-bora-3,5-diazapentane
     Chemical Physics Letters, vol. 259, no. 1-2, pp. 173–177, 1996
131. The structure of () clusters
     Chemical Physics Letters, vol. 262, no. 1-2, pp. 167–174, 1996
132. The effect of the range of the potential on the structures of clusters
     The Journal of Chemical Physics, vol. 103, no. 10, p. 4234, 1995
133. Potential energy surfaces of van der Waals complexes of water and hydrogen halides modeled using distributed multipoles
     The Journal of Chemical Physics, vol. 102, no. 13, p. 5551, 1995
134. Coexistence and phase separation in clusters: From the small to the not-so-small regime
     The Journal of Chemical Physics, vol. 103, no. 8, p. 3061, 1995
135. Calculation of thermodynamic properties of small Lennard-Jones clusters incorporating anharmonicity
     The Journal of Chemical Physics, vol. 102, no. 24, p. 9659, 1995
136. An order parameter approach to coexistence in atomic clusters
     The Journal of Chemical Physics, vol. 102, no. 24, p. 9673, 1995
137. Reaction path zero-point energy from diffusion Monte Carlo calculations
     The Journal of Chemical Physics, vol. 102, no. 4, p. 1592, 1995
138. Rearrangements of 55-atom Lennard-Jones and (C60)55 clusters
     The Journal of Chemical Physics, vol. 101, no. 5, p. 3750, 1994
139. Journal of Physical Chemistry, vol. 98, no. 33, pp. 7942–7944, 1994
140. Topography of potential-energy surfaces for Van der Waals complexes
     Faraday Discussions, vol. 97, p. 243, 1994
141. Clusters of C60 molecules
     Journal of the Chemical Society, Faraday Transactions, vol. 90, no. 8, p. 1061, 1994
142. Transition vector symmetry and the internal pseudo-rotation and inversion paths of CIF4 +
     Journal of the Chemical Society, Faraday Transactions, vol. 90, no. 13, p. 1831, 1994
143. Gradient-line reaction paths for 1,2, H shift reactions in phosphinonitrene and formaldehyde, and H2 elimination from formaldehyde
     Journal of the Chemical Society, Faraday Transactions, vol. 90, no. 13, p. 1839, 1994
144. Electronic structure of small silicon clusters
     Physical Review A, vol. 49, no. 3, pp. 2195–2198, 1994
145. Rearrangements in model face-centered-cubic solids
     Physical Review B, vol. 50, no. 17, pp. 12342–12361, 1994
146. Coexistence in Finite Systems
     Physical Review Letters, vol. 73, no. 21, pp. 2875–2878, 1994
147. Journal of the American Chemical Society, vol. 115, no. 24, pp. 11180–11190, 1993
148. Journal of the American Chemical Society, vol. 115, no. 24, pp. 11191–11201, 1993
149. Locating stationary points for clusters in cartesian coordinates
     Journal of the Chemical Society, Faraday Transactions, vol. 89, no. 9, p. 1305, 1993
150. Journal of the American Chemical Society, vol. 115, no. 4, pp. 1557–1567, 1993
151. Structure and rearrangements of small trapped-ion clusters
     Physical Review A, vol. 47, no. 1, pp. 380–393, 1993
152. Structure, dynamics, and thermodynamics of model (H2O)8 and (H2O)20 clusters
     The Journal of Chemical Physics, vol. 98, no. 9, p. 7245, 1993
153. Rearrangements of model (H2O)8 and (H2O)20 clusters
     The Journal of Chemical Physics, vol. 98, no. 9, p. 7257, 1993
154. Structure and dynamics of model metal clusters
     The Journal of Chemical Physics, vol. 98, no. 7, p. 5720, 1993
155. Chaos in small clusters of inert gas atoms
     The Journal of Chemical Physics, vol. 96, no. 2, p. 1376, 1992
156. Structure and energetics of model metal clusters
     The Journal of Chemical Physics, vol. 96, no. 11, p. 8520, 1992
157. Spectroscopic signature of fractal excitons
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 10, p. 1359, 1992
158. Basins of attraction for stationary points on a potential-energy surface
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 5, p. 653, 1992
159. Limitations of the Murrell?Laidler theorem
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 4, p. 543, 1992
160. Simulated transmission electron microscope images and characterisation of concentric shell and icospiral graphitic microparticles
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 19, p. 2815, 1992
161. Structures and rearrangements of model silicon clusters
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 23, p. 3409, 1992
162. Journal of the American Chemical Society, vol. 114, no. 13, pp. 5399–5406, 1992
163. Systematic investigation of the structures and rearrangements of six-atom clusters bound by a model anisotropic potential
     Journal of the Chemical Society, Faraday Transactions, vol. 88, no. 22, p. 3295, 1992
164. Packing schemes for Lennard-Jones clusters of 13 to 150 atoms: minima, transition states and rearrangement mechanisms
     Journal of the Chemical Society, Faraday Transactions, vol. 87, no. 2, p. 215, 1991
165. Instantaneous normal mode analysis and coexistence phenomena in small clusters
     Journal of the Chemical Society, Faraday Transactions, vol. 87, no. 15, p. 2399, 1991
166. Calculating the rate of loss of information from chaotic time series by forecasting
     Nature, vol. 350, no. 6318, Article ID 350485a0, 3 pages, 1991
167. Stable Configurations of Confined Cold Ionic Systems
     Proceedings of the National Academy of Sciences, vol. 88, no. 2, pp. 483–486, 1991
168. Structural and topological consequences of anisotropic interactions in clusters
     Journal of the Chemical Society, Faraday Transactions, vol. 86, no. 21, p. 3505, 1990
169. Clusters in inorganic and molecular beam chemistry. Some unifying principles
     Accounts of Chemical Research, vol. 23, no. 1, pp. 17–22, 1990
170. Journal of the American Chemical Society, vol. 112, no. 3, pp. 930–932, 1990
171. Journal of the American Chemical Society, vol. 112, no. 22, pp. 7908–7915, 1990
172. Melting and freezing of small argon clusters
     The Journal of Chemical Physics, vol. 92, no. 7, p. 4283, 1990
173. Exploring potential energy surfaces with transition state calculations
     The Journal of Chemical Physics, vol. 92, no. 7, p. 4308, 1990
174. How the range of pair interactions governs features of multidimensional potentials
     The Journal of Chemical Physics, vol. 93, no. 12, p. 8745, 1990
175. Freezing, melting, spinodals, and clusters
     The Journal of Chemical Physics, vol. 92, no. 7, p. 4473, 1990
176. Finding saddle points for clusters
     The Journal of Chemical Physics, vol. 91, no. 11, p. 7002, 1989
177. Structure and growth of colloidal metal particles
     The Journal of Chemical Physics, vol. 91, no. 1, p. 603, 1989
178. Inorganic Chemistry, vol. 28, no. 16, pp. 3120–3127, 1989
179. Inorganic Chemistry, vol. 28, no. 14, pp. 2748–2754, 1989
180. Inorganic Chemistry, vol. 28, no. 14, pp. 2754–2764, 1989
181. Freezing, melting, spinodals, and clusters
     Physical Review Letters, vol. 63, no. 11, pp. 1156–1159, 1989
182. Inorganic Chemistry, vol. 26, no. 23, pp. 3845–3850, 1987