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  • Currently displaying 19301 - 19320 of 29639 publications
Author(s)
Publication title
Journal Name
Publication year
Monte Carlo study of the isotropic and nematic phases of infinitely thin hard platelets
R Eppenga, D Frenkel
Molecular Physics
(2006)
52
Dipole polarizability formulae
D Bishop, LM Cheung, AD Buckingham
Molecular Physics
(2006)
41
A new approach to bonding in transition metal clusters
AJ Stone
Molecular Physics
(2006)
41
Exchange functionals and potentials
R Neumann, RH Nobes, NC Handy
Molecular Physics
(2006)
87
Solid-solid and liquid-solid phase equilibria for the restricted primitive model
B Smit, K Esselink, D Frenkel
Molecular Physics
(2006)
87
Evaluation of anisotropic model intermolecular pair potentials using an ab initio SCF-CI surface
SL Price, AJ Stone
Molecular Physics
(2006)
40
The pair polarizability anisotropy of SF6in the point-atom-polarizability approximation
AD Buckingham, KLC Hunt
Molecular Physics
(2006)
40
Raman spectra of asymmetric top molecules
RB Foster, GW Hills, WJ Jones
Molecular Physics
(2006)
33
Symmetry rules for the indirect nuclear spin-spin coupling tensor revisited
AD Buckingham, P Pyykkö, JB Robert, L Wiesenfeld
Molecular Physics
(2006)
46
Quadrature schemes for integrals of density functional theory
CW Murray, NC Handy, GJ Laming
Molecular Physics
(2006)
78
Ubiquitin: A Small Protein Folding Paradigm
SE Jackson
ChemInform
(2006)
37
An experiment in crystal structure prediction by popular vote
GM Day, WDS Motherwell
Crystal Growth and Design
(2006)
6
Ray scattering study of the effect of hydration on the cross-β structure of amyloid fibrils
AM Squires, GL Devlin, SL Gras, AK Tickler, CE MacPhee, CM Dobson
J Am Chem Soc
(2006)
128
Desolvation tips the balance: solvent effects on aromatic interactions
SL Cockroft, CA Hunter
Chemical communications (Cambridge, England)
(2006)
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
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
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