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- Currently displaying 20441 - 20460 of 30949 publications
Molecular-dynamics simulation of argon physisorbed on magnesium oxide
Molecular Physics
(2006)
69
703
(doi: 10.1080/00268979000100521)
A study of vibrational dephasing of the a1 modes of CH3CN in a computer simulation of the liquid phase
Molecular Physics
(2006)
60
1189
(doi: 10.1080/00268978700100791)
Validity of the high temperature approximation and influence of polydispersity on the phase separation in charged colloidal dispersions
Molecular Physics
(2006)
56
385
(doi: 10.1080/00268978500102391)
On the equilibrium structure of dense fluids
Molecular Physics
(2006)
63
747
(doi: 10.1080/00268978800100541)
Reorientation of N2adsorbed on graphite in various computer simulated phases
Molecular Physics
(2006)
54
183
(doi: 10.1080/00268978500100151)
Approximate relation between the melting of hard spheres and ellipsoidal platelets and needles
Molecular Physics
(2006)
54
145
(doi: 10.1080/00268978500100121)
INTERMOLECULAR PERTURBATION-THEORY APPLICATIONS TO HEBE, ARHF, ARHCL AND NEH2
Molecular Physics
(2006)
53
107
(doi: 10.1080/00268978400102161)
An intermolecular perturbation theory for the region of moderate overlap
Molecular Physics
(2006)
53
83
(doi: 10.1080/00268978400102151)
Matrix elements between determinantal wavefunctions of non-orthogonal orbitals
Molecular Physics
(2006)
53
69
(doi: 10.1080/00268978400102141)
Ligand Field Effects on the Aqueous Ru(III)/Ru(II) Redox Couple from an All-Atom Density Functional Theory Perspective
J Chem Theory Comput
(2006)
2
1403
(doi: 10.1021/ct600169e)
The long range model of intermolecular forces
Molecular Physics
(2006)
50
1349
(doi: 10.1080/00268978300103091)
A simple model for solutions of liquid alkali and alkali halides
Molecular Physics
(2006)
50
901
(doi: 10.1080/00268978300102751)
Electromagnetic properties of BH (1Σ+) using CASSCF wavefunctions
Molecular Physics
(2006)
49
1277
(doi: 10.1080/00268978300101931)
A variational method for the calculation of rovibrational levels of any triatomic molecule
Molecular Physics
(2006)
49
745
(doi: 10.1080/00268978300101521)
Electric field-gradient-induced birefringence in N2, C2H6, C3H6, Cl2, N2O and CH3F
Molecular Physics
(2006)
49
703
(doi: 10.1080/00268978300101481)
A POTENTIAL-ENERGY SURFACE FOR THE GROUND-STATE OF CH2
Molecular Physics
(2006)
49
681
(doi: 10.1080/00268978300101461)
Molecular dynamics study of the dynamical properties of an assembly of infinitely thin hard rods
Molecular Physics
(2006)
49
503
(doi: 10.1080/00268978300101331)
Radial distribution functions for inverse-12 (‘soft sphere’) fluids
Molecular Physics
(2006)
23
853
(doi: 10.1080/00268977200100851)
