Molecular Physics

Title Publication Date Language Citations
Rotational spectrum, internal rotation barrier and structure of 3,3,3-trifluoropropene1997/07/01English
Critical phenomena in rotational spectra of an asymmetric triatomic molecule1997/06/10
Dynamic disorder in 2,3-dimethylnaphthalene: a single crystal deuteron nuclear magnetic resonance study1998/12/15
The influence of the heteronuclear dipolar interaction on nuclear magnetic resonance spectra of quadrupolar nuclei1998/12/15
Quantum description of five-particle systems in principal-axis hyperspherical coordinates2000/03/20
ERRATUM The structure of pure tertiary butanol1998/06/01English
An ordered structure for binary mixtures of rare gas atoms from numerical simulation1996/10/01English
High-resolution FTIR spectroscopy of the ν 11 and ν 2 + ν 7 bands of ethylene-d 42000/05/10
Comment2002/01/10English
Millimetre wave and diode laser spectroscopy of IC15N: anharmonic force field of cyanogen iodide from spectroscopic data andab initiocalculations1998/01/01English
A new classical method for dynamical calculation in molecular systems1997/03/01English
The reactions of Cl+(3P) and Cl+(1D) with hydrogen sulphide. A G2 molecular orbital study1999/01/20
Quantum cluster equilibrium theory of liquids: molecular clusters and thermodynamics of liquid ethanol1999/08/20
INVITED PAPER Samuel Francis Boys 1911-19721996/05/01English
Monte Carlo simulation of a hard-sphere gas in the planar Fourier flow with a gravity field2000/02/20
Degeneracy splitting of the nu4 mode of CH4 adsorbed in NaA. Comparison with the splitting of nu31999/03/20
Singular value decomposition of energy matrices in theoretical atomic structure calculations2000/08/01English
High resolution infrared study of the parallel band nu3 of chloroform CH35Cl1999/05/20
Rotational relaxation time in CO free jets2000/03/20
The intermolecular potential of NH 4 + -Ar I. Calculations for the internal rotor structure of the nu 3 band2000/01/20
RESEARCH NOTE Analytical model for thermodynamic properties of an adhesive hard sphere Yukawa fluid1999/02/10
Rotational dynamics and velocity segregation in plastic KClO4 : a molecular dynamics simulation1998/04/01English
Identification of lomustine drug by graphyne-like boron nitride: DFT approach2024/02/17English
Theoretical exploration of the spin-orbit coupled potential energy surface of the Mg + –He molecular ion2024/02/17English
The potential energy surface and superatomic properties of the octahedral PtSn 5 cluster2024/02/17English
The thermal diffusion factor of Ar-CO 2 mixtures: new measurements and comparison with quantum calculations1999/10/20
Symmetrized rovibrational local states for triply degenerate modes of spherical molecules: application to intensity calculations in the upsilon3 ladder1998/04/01English
The concentration dependence of the proton chemical shift and the deuterium quadrupole coupling parameter for binary solutions of ethanol2000/06/10
ERRATUM A simple method to calculate dispersion coefficients for isolated and condensed-phase species1999/03/20
The rotational spectrum of 2-indanone1999/10/20