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- Currently displaying 641 - 654 of 654 publications
skeletal rearrangements in clusters III. applications of vibrational analysis
– Polyhedron
(1989)
15,
1933
Skeletal Rearrangements in Clusters. 2
– Inorganic Chemistry
(1989)
28,
2754
(doi: 10.1021/ic00313a013)
Freezing, melting, spinodals, and clusters.
– Physical review letters
(1989)
63,
1156
(doi: 10.1103/PhysRevLett.63.1156)
Closed-shell structures and the building game
– Chem. Phys. Lett.
(1987)
141,
478
(doi: 10.1016/0009-2614(87)85064-9)
A new structural tensor surface harmonic bonding theory
– \molphys
(1987)
61,
747-765
(doi: 10.1080/00268978700101431)
Theoretical studies of icosahedral C60 and some related species
– Chemical Physics Letters
(1986)
128,
501
(doi: 10.1016/0009-2614(86)80661-3)
100 Years of the Lennard-Jones Potential
– Journal of Chemical Theory and Computation
Chemical Energy Landscapes of Hardware-Efficient Ansätze in Quantum Computing
– Journal of Chemical Theory and Computation
MELTING AND FREEZING OF SMALL ARGON CLUSTERS
– JOURNAL OF CHEMICAL PHYSICS
92,
{4283-4295}
OPTIM: A program for optimising geometries and calculating pathways
GMIN: A program for basin-hopping global optimisation
PATHSAMPLE: A program for generating connected stationary point databases and extracting global kinetics
OPTIM: A program for geometry optimisation and pathway calculations
