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  • Currently displaying 19301 - 19320 of 29898 publications
Author(s)
Publication title
Journal Name
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DETERMINATION OF DERIVATIVES OF THE POLARIZABILITY ANISOTROPY IN DIATOMIC-MOLECULES .1. THEORETICAL CONSIDERATIONS ON VIBRATION-ROTATION RAMAN INTENSITIES
H-O Hamaguchi, I Suzuki, AD Buckingham
Molecular Physics
(2006)
43
Molecular light scattering—A spherical tensor approach
RJA Tough, AJ Stone
Molecular Physics
(2006)
37
Formulae for the first and second derivatives of anisotropie potentials with respect to geometrical parameters
PLA Popelier, AJ Stone
Molecular Physics
(2006)
82
The emission bands of HO2 between 1·43 and 1·51 µm
RP Tuckett, PA Freedman, WJ Jones
Molecular Physics
(2006)
37
A HIGH-RESOLUTION FTIR SPECTROSCOPIC STUDY OF THE 1-4VI BANDS OF N2O3
LA Chewter, IWM Smith, G Yarwood
Molecular Physics
(2006)
63
Molecular dynamics study of the dynamical properties of an assembly of infinitely thin hard rods
D Frenkel, JF Maguire
Molecular Physics
(2006)
49
The relaxation matrices for AX2 and AX3 nuclear spin systems
AD Bain, RM Lynden-Bell
Molecular Physics
(2006)
30
A potential energy surface for the ground state of CH2
P Knowles, NC Handy, S Carter
Molecular Physics
(2006)
49
DETERMINATION OF DERIVATIVES OF THE POLARIZABILITY ANISOTROPY IN DIATOMIC-MOLECULES .2. THE HYDROGEN AND NITROGEN MOLECULES
H-O Hamaguchi, AD Buckingham, WJ Jones
Molecular Physics
(2006)
43
On the equilibrium structure of dense fluids
JL Barrat, JP Hansen, G Pastore
Molecular Physics
(2006)
63
Distributed multipole analysis
AJ Stone, M Alderton
Molecular Physics
(2006)
56
INTERMOLECULAR PERTURBATION-THEORY APPLICATIONS TO HEBE, ARHF, ARHCL AND NEH2
IC Hayes, GJB Hurst, AJ Stone
Molecular Physics
(2006)
53
Reorientational correlation functions for computer-simulated liquids of tetrahedral molecules
RM Lynden-Bell, IR McDonald
Molecular Physics
(2006)
43
Ligand Field Effects on the Aqueous Ru(III)/Ru(II) Redox Couple from an All-Atom Density Functional Theory Perspective
R Ayala, M Sprik
J Chem Theory Comput
(2006)
2
Diode laser spectroscopy of the 7i-6h and 7h-6g transitions in H2
FJ Basterrechea, PB Davies, DM Smith, RJ Stickland
Molecular Physics
(2006)
81
The long range model of intermolecular forces
PW Fowler, AD Buckingham
Molecular Physics
(2006)
50
A new basis set for molecular wavefunctions
DJ Allison, NC Handy, SF Boys
Molecular Physics
(2006)
26
A variational method for the calculation of rovibrational levels of any triatomic molecule
S Carter, NC Handy, BT Sutcliffe
Molecular Physics
(2006)
49
Validity of the high temperature approximation and influence of polydispersity on the phase separation in charged colloidal dispersions
JP Hansen, L Reatto, M Tau, JM Victor
Molecular Physics
(2006)
56
Matrix elements between determinantal wavefunctions of non-orthogonal orbitals
IC Hayes, AJ Stone
Molecular Physics
(2006)
53