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  • Currently displaying 18861 - 18880 of 29255 publications
Author(s)
Publication title
Journal Name
Publication year
Formulae for the first and second derivatives of anisotropie potentials with respect to geometrical parameters
PLA Popelier, AJ Stone
Molecular Physics
(2006)
82
A study of the induced dipole moments in Li+F- and Li+ … Ne
SAC McDowell, AD Buckingham
Molecular Physics
(2006)
80
Spin-orbit interactions from self consistent field wavefunctions
MJ Bearpark, NC Handy, P Palmieri, R Tarroni
Molecular Physics
(2006)
80
Matrix elements between determinantal wavefunctions of non-orthogonal orbitals
IC Hayes, AJ Stone
Molecular Physics
(2006)
53
An intermolecular perturbation theory for the region of moderate overlap
IC Hayes, AJ Stone
Molecular Physics
(2006)
53
Electric field-gradient-induced birefringence in N2, C2H6, C3H6, Cl2, N2O and CH3F
AD Buckingham, C Graham, JH Williams
Molecular Physics
(2006)
49
INTERMOLECULAR PERTURBATION-THEORY APPLICATIONS TO HEBE, ARHF, ARHCL AND NEH2
IC Hayes, GJB Hurst, AJ Stone
Molecular Physics
(2006)
53
A new basis set for molecular wavefunctions
DJ Allison, NC Handy, SF Boys
Molecular Physics
(2006)
26
RADIAL DISTRIBUTION FUNCTIONS FOR INVERSE-12 (SOFT SPHERE) FLUIDS
JP Hansen, JJ Weis
Molecular Physics
(2006)
23
Distributed multipole analysis
AJ Stone, M Alderton
Molecular Physics
(2006)
56
FAR INFRA-RED LASER MAGNETIC-RESONANCE (LMR) SPECTRA OF SH AND SD, (X-2-II-3-2)
PB Davies, BJ Handy, EKM Lloyd, DK Russell
Molecular Physics
(2006)
36
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
A POTENTIAL-ENERGY SURFACE FOR THE GROUND-STATE OF CH2
P Knowles, NC Handy, S Carter
Molecular Physics
(2006)
49
Distributed polarizabilities
AJ Stone
Molecular Physics
(2006)
56
Molecular dynamics study of the dynamical properties of an assembly of infinitely thin hard rods
D Frenkel, JF Maguire
Molecular Physics
(2006)
49
Chemical shift calculations for carbon, nitrogen and oxygen in simple molecules
A Velenik, RM Lynden-Bell
Molecular Physics
(2006)
19
Reorientation of N2 adsorbed on graphite in various computer simulated phases
RM Lynden-Bell, J Talbot, DJ Tildesley, WA Steele
Molecular Physics
(2006)
54
The relaxation matrices for AX2 and AX3 nuclear spin systems
AD Bain, RM Lynden-Bell
Molecular Physics
(2006)
30
Coupling of vibrational and reorientational dephasing in mobile liquids
RM Lynden-Bell
Molecular Physics
(2006)
36
The emission bands of HO2 between 1·43 and 1·51 μm
RP Tuckett, PA Freedman, WJ Jones
Molecular Physics
(2006)
37