Effective polarizability operator for X2Y-type molecules. Application to line width and line shift calculations of H2O

Abstract

The expressions for the second-order rotational correction terms of the effective polarizability operator of asymmetric rotors have been derived using the method of contact transformation. The correction terms have been calculated for the H₂O molecule. The influence of the rotational contributions on the halfwidths and shifts of some selected lines of H₂O perturbed by the atoms of inert gases and N₂ molecule is investigated.

Original language	English
Pages (from-to)	81-88
Number of pages	8
Journal	Journal of Molecular Structure
Volume	646
Issue number	1-3
DOIs	https://doi.org/10.1016/S0022-2860(02)00613-0
Publication status	Published - 19 Feb 2003

Keywords

Effective polarizability
Line widths and line shifts of HO

ASJC Scopus subject areas

Structural Biology
Organic Chemistry
Physical and Theoretical Chemistry
Spectroscopy
Atomic and Molecular Physics, and Optics

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10.1016/S0022-2860(02)00613-0

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title = "Effective polarizability operator for X2Y-type molecules. Application to line width and line shift calculations of H2O",

abstract = "The expressions for the second-order rotational correction terms of the effective polarizability operator of asymmetric rotors have been derived using the method of contact transformation. The correction terms have been calculated for the H2O molecule. The influence of the rotational contributions on the halfwidths and shifts of some selected lines of H2O perturbed by the atoms of inert gases and N2 molecule is investigated.",

keywords = "Effective polarizability, Line widths and line shifts of HO",

author = "Starikov, {V. I.} and Protasevich, {A. E.}",

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AU - Starikov, V. I.

AU - Protasevich, A. E.

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Y1 - 2003/2/19

N2 - The expressions for the second-order rotational correction terms of the effective polarizability operator of asymmetric rotors have been derived using the method of contact transformation. The correction terms have been calculated for the H2O molecule. The influence of the rotational contributions on the halfwidths and shifts of some selected lines of H2O perturbed by the atoms of inert gases and N2 molecule is investigated.

AB - The expressions for the second-order rotational correction terms of the effective polarizability operator of asymmetric rotors have been derived using the method of contact transformation. The correction terms have been calculated for the H2O molecule. The influence of the rotational contributions on the halfwidths and shifts of some selected lines of H2O perturbed by the atoms of inert gases and N2 molecule is investigated.

KW - Effective polarizability

KW - Line widths and line shifts of HO

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U2 - 10.1016/S0022-2860(02)00613-0

DO - 10.1016/S0022-2860(02)00613-0

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JF - Journal of Molecular Structure

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ER -

Effective polarizability operator for X₂Y-type molecules. Application to line width and line shift calculations of H₂O

Abstract

Keywords

ASJC Scopus subject areas

Access to Document

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Fingerprint Dive into the research topics of 'Effective polarizability operator for X<sub>2</sub>Y-type molecules. Application to line width and line shift calculations of H<sub>2</sub>O'. Together they form a unique fingerprint.

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