Ab initio studies of the interactions in Van der Waals molecules

A van der Avoird, PES Wormer, F Mulder… - Van der Waals …, 1980 - Springer
Van der Waals molecules are complexes of molecules (or atoms) which are not held
together by chemical bonding, as" normal" molecules, but by weaker Van der Waals forces …

[图书][B] Collisional line broadening and shifting of atmospheric gases: a practical guide for line shape modelling by current semi-classical approaches

J Buldyreva, NN Lavrentieva, VI Starikov - 2010 - books.google.com
This book presents a comprehensive overview of the modern theory of spectral line
broadening and shifting by pressure of atmospheric gases. It describes current semi …

Interaction site models for molecular fluids

PT Cummings, G Stell - Molecular Physics, 1982 - Taylor & Francis
A detailed study is made of the atom-atom (ie site-site) correlation functions—especially the
direct correlation function—for the interaction site model (ISM) of Andersen and Chandler …

Fully complex implementation of the Robert–Bonamy formalism: Half widths and line shifts of H2O broadened by N2

R Lynch, RR Gamache, SP Neshyba - The Journal of chemical physics, 1996 - pubs.aip.org
The complex semiclassical formalism of Robert and Bonamy is used to calculate both half
widths and line shifts for water vapor in a bath of nitrogen. The assumed intermolecular …

Spherical tensor theory of long-range intermolecular forces

AJ Stone, RJA Tough - Chemical physics letters, 1984 - Elsevier
General expressions are given for the electrostatic, induction and dispersion energies of a
pair of interacting, molecules in terms of spherical tensor components of the molecular …

Semiclassical calculations of half-widths and line shifts for transitions in the 30012← 00001 and 30013← 00001 bands of CO2, I: Collisions with N2

RR Gamache, J Lamouroux, AL Laraia… - Journal of Quantitative …, 2012 - Elsevier
Calculations of the half-width, its temperature dependence, and the line shift are made for
the rotational states J= 0–120 for two of the Fermi-tetrad bands (30012← 00001 and …

[HTML][HTML] N2 and O2 induced halfwidths and line shifts of water vapor transitions in the (301)←(000) and (221)←(000) bands

R Lynch, RR Gamache, SP Neshyba - Journal of Quantitative Spectroscopy …, 1998 - Elsevier
Using a complex version of Robert–Bonamy theory (CRBF), the role of the intermolecular
potential in the pressure broadening of water perturbed by nitrogen and oxygen is studied …

Perturbation theory with a hard dumbbell reference system. I. Application to liquid nitrogen

F Kohler, N Quirke, JW Perram - The Journal of Chemical Physics, 1979 - pubs.aip.org
We present a perturbation theory of molecular fluids which uses an anisotropic reference
assembly. At each orientation, the potential is divided according to the Weeks–Chandler …

Pressure‐induced widths and shifts for the ν3 band of methane

SP Neshyba, R Lynch, R Gamache, T Gabard… - The Journal of …, 1994 - pubs.aip.org
Methane has the second highest radiative forcing! of the climate system due to measured
greenhouse gas change since 1850, second only to CO2, Methane is also a minor …

Theoretical calculations of pressure broadening coefficients for H2O perturbed by hydrogen or helium gas

RR Gamache, R Lynch, LR Brown - Journal of Quantitative Spectroscopy …, 1996 - Elsevier
To aid in the reduction of remote-sensing data from the outer planets, collision-broadened
halfwidths are calculated for water vapor broadened by H2 and are estimated for He …