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  • Currently displaying 20261 - 20280 of 30706 publications
Author(s)
Publication title
Journal Name
Publication year
Towards an accurate intermolecular potential for water
C Millot, AJ Stone
Molecular Physics
(2006)
77
Solid-solid and liquid-solid phase equilibria for the restricted primitive model
B Smit, K Esselink, D Frenkel
Molecular Physics
(2006)
87
Exchange functionals and potentials
R Neumann, RH Nobes, NC Handy
Molecular Physics
(2006)
87
Rovibronic 2B1(Πu)-2A1 spectrum of the BH2 radical
M Brommer, P Rosmus, S Carter, NC Handy
Molecular Physics
(2006)
77
Coexistence in small inert gas clusters
DJ Wales
Molecular Physics
(2006)
78
Ray scattering study of the effect of hydration on the cross-beta structure of amyloid fibrils
AM Squires, GL Devlin, SL Gras, AK Tickler, CE MacPhee, CM Dobson
Journal of the American Chemical Society
(2006)
128
An Experiment in Crystal Structure Prediction by Popular Vote
GM Day, WDS Motherwell
Crystal Growth & Design
(2006)
6
Desolvation tips the balance: solvent effects on aromatic interactions.
SL Cockroft, CA Hunter
Chemical Communications
(2006)
Ubiquitin: A Small Protein Folding Paradigm
SE Jackson
ChemInform
(2006)
37
Coordination modes of pyridine-carboxylic acid derivatives in samarium (III) complexes
PCR Soares-Santos, FAA Paz, RAS Ferreira, J Klinowski, LD Carlos, T Trindade, HIS Nogueira
Polyhedron
(2006)
25
Pressure dependence of the electrical properties of amorphous phosphorus prepared by chemical transport in a low-pressure hydrogen plasma
P Extance, SR Elliott
Philosophical Magazine B
(2006)
43
A continuous random network approach to the structure of vitreous boron trioxide
SR Elliott
Philosophical Magazine B
(2006)
37
Temperature dependence of a.c. conductivity of chalcogenide glasses
SR Elliott
Philosophical Magazine B
(2006)
37
The mechanism for a.c. conduction in chalcogenide semiconductors: Electronic or atomic?
SR Elliott
Philosophical Magazine B
(2006)
40
Pressure dependence of the electrical conductivity of amorphous red phosphorus
P Extance, SR Elliott
Philosophical Magazine B
(2006)
43
CONTRAST-MATCHING SMALL-ANGLE NEUTRON-SCATTERING EXPERIMENTS ON OBLIQUELY EVAPORATED AMORPHOUS GESE3 FILMS
D Verrall, CA Spence, SR Elliott
Philosophical Magazine B Physics of Condensed Matter Statistical Mechanics Electronic Optical and Magnetic Properties
(2006)
57
The diffusion-controlled relaxation model for ionic transport in glasses
SR Elliott, AP Owens
Philosophical Magazine B Physics of Condensed Matter Statistical Mechanics Electronic Optical and Magnetic Properties
(2006)
60
Photostructural changes in amorphous As50Se50 films: An EXAFS study
SR Elliott, AV Kolobov
Philosophical Magazine B
(2006)
61
On the mechanism of photodoping in vitreous chalcogenides
AV Kolobov, SR Elliott, MA Taguirdzhanov
Philosophical Magazine B Physics of Condensed Matter Statistical Mechanics Electronic Optical and Magnetic Properties
(2006)
61
Structure and energetics of model symmetric and asymmetric decahedra
J Uppenbrink, DJ Wales, AI Kirkland, DA Jefferson, J Urban
Philosophical Magazine B Physics of Condensed Matter Statistical Mechanics Electronic Optical and Magnetic Properties
(2006)
65