Quantum-mechanical vs. semi-classical spectral-line widths and shifts from the line core in the non-impact region for the Ar-perturbed/ K-radiator system
Creators
- 1. Research and Instructional Computer Center and the Chemistry Department, Wright State University, Dayton, OH 45435 (United States)
Description
New quantum-mechanical (QM) and semi-classical (SC) shifts (d's) and widths (HWHM's, w's) were measured from the line core of computed full spectral-line shapes for the Ar-perturbed/K-radiator system (K/Ar). The initial state of our model was based on a 4p 2 P 3/2,1/2 pseudo-potential for the K/Ar system, and the final state on a zero potential. The Fourier transform of the line shape formed the basis for the computations. Excellent agreement was found between the QM and SC values of d and of w in a high-pressure (P) non-impact region, which was characterized by a √P dependence of w and a P dependence of d. These agreements were shown to be another example of a correspondence between classical (SC) quantities and QM quantities in the limit of large quantum numbers. Typically at P=1x106 Torr and T=400 K, wQM=448 cm-1 and wSC =479 cm-1, where the deviation from the mean is ±3.3%. Also, dQM =-3815 cm-1 and dSC =-3716 cm-1, where the deviation from the mean is ±1.3%. A new general method was formulated which yielded a definite pressure P 0, which was defined as an upper limit to the low-pressure impact approximation and a lower limit to the non-impact region
Additional details
Identifiers
- DOI
- 10.1016/j.jqsrt.2007.01.044;
- PII
- S0022-4073(07)00067-2;
Publishing Information
- Journal Title
- Journal of Quantitative Spectroscopy and Radiative Transfer
- Journal Volume
- 107
- Journal Issue
- 1
- Journal Page Range
- p. 154-163
- ISSN
- 0022-4073
- CODEN
- JQSRAE
INIS
- Country of Publication
- United Kingdom
- Country of Input or Organization
- International Atomic Energy Agency (IAEA)
- INIS RN
- 39036955
- Subject category
- S71: CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSICS;
- Descriptors DEI
- APPROXIMATIONS; FOURIER TRANSFORMATION; LINE WIDTHS; POTENTIALS; QUANTUM MECHANICS; QUANTUM NUMBERS; SHAPE; SPECTRA; WIDTH
- Descriptors DEC
- CALCULATION METHODS; DIMENSIONS; INTEGRAL TRANSFORMATIONS; MECHANICS; TRANSFORMATIONS
Optional Information
- Copyright
- Copyright (c) 2007 Elsevier Science B.V., Amsterdam, The Netherlands, All rights reserved.