Yusuf Hamied Department of Chemistry

Publications

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  • Currently displaying 19801 - 19820 of 30304 publications
Author(s)
Publication title
Journal Name
Publication year
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
(doi: 10.1021/ct600169e)
Distributed polarizabilities
AJ Stone
Molecular Physics
(2006)
56
(doi: 10.1080/00268978500102901)
A new basis set for molecular wavefunctions
DJ Allison, NC Handy, SF Boys
Molecular Physics
(2006)
26
(doi: 10.1080/00268977300102031)
Molecular dynamics study of the dynamical properties of an assembly of infinitely thin hard rods
D Frenkel, JF Maguire
Molecular Physics
(2006)
49
(doi: 10.1080/00268978300101331)
A study of vibrational dephasing of the A 1 modes of CH3CN in a computer simulation of the liquid phase
P-O Westlund, RM Lynden-Bell
Molecular Physics
(2006)
60
(doi: 10.1080/00268978700100791)
Structure and thermodynamics of dilute liquid multicomponent systems
G Kahl, J-P Hansen
Molecular Physics
(2006)
67
(doi: 10.1080/00268978900101131)
On the equilibrium structure of dense fluids
JL Barrat, JP Hansen, G Pastore
Molecular Physics
(2006)
63
(doi: 10.1080/00268978800100541)
The relaxation matrices for AX2 and AX3 nuclear spin systems
AD Bain, RM Lynden-Bell
Molecular Physics
(2006)
30
(doi: 10.1080/00268977500101981)
Semiclassical eigenvalues for non-separable bound systems from classical trajectories: The degenerate case
KS Sorbie, NC Handy
Molecular Physics
(2006)
32
(doi: 10.1080/00268977600102721)
A high resolution FTIR spectroscopic study of the nv 1 (n = 1–4) bands of N2O3
LA Chewter, IWM Smith, G Yarwood
Molecular Physics
(2006)
63
(doi: 10.1080/00268978800100601)
A simple model for solutions of liquid alkali and alkali halides
G Chabrier, JP Hansen
Molecular Physics
(2006)
50
(doi: 10.1080/00268978300102751)
The long range model of intermolecular forces
PW Fowler, AD Buckingham
Molecular Physics
(2006)
50
(doi: 10.1080/00268978300103091)
Matrix elements between determinantal wavefunctions of non-orthogonal orbitals
IC Hayes, AJ Stone
Molecular Physics
(2006)
53
(doi: 10.1080/00268978400102141)
An intermolecular perturbation theory for the region of moderate overlap
IC Hayes, AJ Stone
Molecular Physics
(2006)
53
(doi: 10.1080/00268978400102151)
INTERMOLECULAR PERTURBATION-THEORY APPLICATIONS TO HEBE, ARHF, ARHCL AND NEH2
IC Hayes, GJB Hurst, AJ Stone
Molecular Physics
(2006)
53
(doi: 10.1080/00268978400102161)
ELECTRIC FIELD-GRADIENT-INDUCED BIREFRINGENCE IN N-2, C2H6, C3H6, CL-2, N2O AND CH3F
AD Buckingham, C Graham, JH Williams
Molecular Physics
(2006)
49
(doi: 10.1080/00268978300101481)
Approximate relation between the melting of hard spheres and ellipsoidal platelets and needles
D Frenkel
Molecular Physics
(2006)
54
(doi: 10.1080/00268978500100121)
Scaling properties of inhomogeneity kinetic energy in some diatomic molecules, in relation to dissociation energies
GJ Laming, A Nagy, NH March
Molecular Physics
(2006)
81
(doi: 10.1080/00268979400101031)
THEORETICAL-STUDY OF THE RENNER-TELLER (A)OVER-TILDE2A1-(X)OVER-TILDE2B1 SYSTEM OF NH2
W Gabriel, G Chambaud, P Rosmus, S Carter, NC Handy
Molecular Physics
(2006)
81
(doi: 10.1080/00268979400100991)
A variational method for the calculation of rovibrational levels of any triatomic molecule
S Carter, NC Handy, BT Sutcliffe
Molecular Physics
(2006)
49
(doi: 10.1080/00268978300101521)
Yusuf Hamied Department of Chemistry
Lensfield Road
Cambridge
CB2 1EW
T: +44 (0) 1223 336300
enquiries@ch.cam.ac.uk
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