Update of line parameters of ozone in the 2550-2900 cm<sup>−1</sup> region

Semen Mikhailenko; Alain Barbe; Marie-Renee De Backer-Barilly; Vladimir G. Tyuterev

doi:10.1364/AO.47.004612

Update of line parameters of ozone in the $2550 - 2900 {cm}^{- 1}$ region

Semen Mikhailenko, Alain Barbe, Marie-Renee De Backer-Barilly, and Vladimir G. Tyuterev

Applied Optics
Vol. 47,
Issue 25,
pp. 4612-4618
(2008)
•https://doi.org/10.1364/AO.47.004612

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Semen Mikhailenko, Alain Barbe, Marie-Renee De Backer-Barilly, and Vladimir G. Tyuterev, "Update of line parameters of ozone in the 2550-2900 cm⁻¹ region," Appl. Opt. 47, 4612-4618 (2008)

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Table of Contents Category
- Spectroscopy
Optics & Photonics Topics
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The topics in this list come from the OSA Optics and Photonics Topics applied to this article.
Previously assigned OCIS codes
- Ozone (010.4950)
- Absorption (300.1030)
- Spectroscopy, Fourier transforms (300.6300)
- Spectroscopy, high-resolution (300.6320)
- Spectroscopy, infrared (300.6340)

About this Article
History
- Original Manuscript: April 3, 2008
- Revised Manuscript: July 23, 2008
- Manuscript Accepted: July 24, 2008
- Published: August 29, 2008

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Abstract

An update of spectroscopic line parameters for the $3.45 - 3.92 μm$ ozone bands is reported. The line list includes the parameters of 15 bands of the main isotopic species and of the $v_{1} + v_{2} + v_{3}$ band of ${}^{16}O {}^{16}O {}^{18}O$ and ${}^{16}O {}^{18}O {}^{16}O$ . The results are based on previous high resolution laboratory studies. Comparisons of experimental spectra with an absorptance simulation of ozone based on the reported line list shows that the latter one is accurate enough for strong, medium, and weak transmittance in the $2550 - 2900 {cm}^{- 1}$ spectral range. The data are available on the Web in the Spectroscopy and Molecular Properties of Ozone (S&MPO, http://smpo.iao.ru and http://ozone.univ-reims.fr) and HITRAN (http://cfa-www.harvard.edu/hitran/) databanks.

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Band	Refs.	Hot Band Factor C of Eqs. (1, 2a, 2b, 3)	Number of Transitions	Region ( ${cm}^{- 1}$ )	$S_{V} \times 10^{22}$ ( ${cm}^{- 1} / molecule {cm}^{- 2}$ at $296 K$ )
$(120) - (000)$	[17, 16]		2095	$2395.22 - 2616.83$	3.562
$(013) - (100)$	[11, 16, 22]		659	$2529.67 - 2607.78$	0.398
$(012) - (000)$	[14, 16]		3886	$2590.30 - 3025.27$	32.930
$(013) - (001)$	[11, 14, 16]	1.67 ^c	775	$2602.31 - 2724.63$	0.458
$(022) - (010)$	[5, 7, 14]	2	1629	$2603.52 - 2769.44$	1.740
$(111) - (000)$	[14, 16]		3604	$2625.81 - 3050.15$	250.900
$(112) - (001)$	[11, 14, 16]	2.29 ^c	1432	$2630.87 - 2719.79$	4.446
$(111) - (000)$ ^a	[26, 27, 28]		1300	$2653.74 - 2739.29$	0.452
$(112) - (100)$	[11, 14, 16]	1	68	$2658.87 - 2717.11$	0.025
$(131) - (020)$	[12, 14, 23]	3	899	$2666.65 - 2741.00$	0.834
$(221) - (110)$	[14, 17, 24]	2	311	$2673.12 - 2727.24$	0.103
$(121) - (010)$	[5, 7, 17]	2	1851	$2678.75 - 2774.42$	16.590
$(211) - (100)$	[9, 14, 16]	2	1242	$2681.75 - 2764.15$	2.540
$(111) - (000)$ ^b	[26, 27, 28]		2337	$2694.17 - 2767.87$	1.023
$(210) - (000)$	[14, 16]		3327	$2703.94 - 3156.28$	8.116
$(211) - (001)$	[9, 14, 16]	1	48	$2713.93 - 2767.58$	0.014
$(013) - (010)$	[5, 11, 14]	1	2459	$2889.23 - 3090.28$	47.350

Region( ${cm}^{- 1}$ )	Intensities Sum	%H ^a	NC	NH	Region( ${cm}^{- 1}$ )	Intensities sum	%H ^a	NC	NH
2500–2500	$6.46 E - 23$	2.1	135	40	2750–2760	$2.68 E - 21$	12.5	351	701
2510–2520	$4.04 E - 23$	3.0	150	36	2760–2770	$4.62 E - 21$	12.3	469	603
2520–2530	$1.83 E - 23$	6.1	85	36	2770–2780	$4.14 E - 21$	4.4	703	386
2530–2540	$1.76 E - 23$	5.9	87	38	2780–2790	$3.70 E - 21$	0.0	577	0
2540–2550	$1.47 E - 23$	10.1	55	51	2790–2800	$7.37 E - 21$	0.0	605	0
2550–2560	$1.33 E - 23$	18.9	59	53	2800–2810	$3.42 E - 21$	0.0	896	0
2560–2570	$1.24 E - 23$	35.8	56	63	2810–2820	$2.90 E - 23$	0.0	205	0
2570–2580	$1.10 E - 23$	51.5	46	64	2820–2830	$3.62 E - 23$	0.0	264	0
2580–2590	$9.97 E - 24$	64.3	43	108	2830–2840	$4.48 E - 23$	0.0	259	0
2590–2600	$7.43 E - 24$	64.2	56	121	2840–2850	$6.51 E - 23$	1.8	238	9
2600–2610	$1.79 E - 23$	83.9	83	230	2850–2860	$9.41 E - 23$	6.7	224	39
2610–2620	$7.02 E - 24$	29.5	112	73	2860–2870	$1.07 E - 22$	14.7	190	57
2620–2630	$1.23 E - 23$	30.9	119	111	2870–2880	$9.11 E - 23$	30.8	196	69
2630–2640	$2.35 E - 23$	34.2	157	208	2880–2890	$1.12 E - 22$	48.0	199	124
2640-2650	$3.88 E - 23$	35.8	178	252	2890–2900	$1.36 E - 22$	65.3	195	243
2650–2660	$6.69 E - 23$	34.9	233	259	2900–2910	$2.28 E - 22$	61.0	238	325
2660–2670	$1.21 E - 22$	45.9	239	410	2910–2920	$2.82 E - 22$	70.3	272	410
2670–2680	$1.72 E - 22$	45.7	250	413	2920–2930	$5.47 E - 22$	92.0	316	564
2680–2690	$2.21 E - 22$	42.1	265	463	2930–2940	$5.07 E - 22$	90.9	276	282
2690–2700	$2.87 E - 22$	40.2	332	874	2940–2950	$6.89 E - 22$	87.5	326	414
2700–2710	$3.60 E - 22$	49.0	324	628	2950–2960	$8.22 E - 22$	78.1	324	545
2710–2720	$4.31 E - 22$	47.5	347	907	2960–2970	$1.69 E - 21$	76.2	350	643
2720–2730	$4.77 E - 22$	42.9	370	598	2970–2980	$2.13 E - 21$	54.1	383	576
2730–2740	$1.42 E - 21$	22.5	440	697	2980–2990	$2.93 E - 21$	26.1	455	436
2740–2750	$1.48 E - 21$	19.4	336	654	2990–3000	$5.09 E - 21$	12.4	530	577

Band	Refs.	Hot Band Factor C of Eqs. (1, 2a, 2b, 3)	Number of Transitions	Region ( ${cm}^{- 1}$ )	$S_{V} \times 10^{22}$ ( ${cm}^{- 1} / molecule {cm}^{- 2}$ at $296 K$ )
$(120) - (000)$	[17, 16]		2095	$2395.22 - 2616.83$	3.562
$(013) - (100)$	[11, 16, 22]		659	$2529.67 - 2607.78$	0.398
$(012) - (000)$	[14, 16]		3886	$2590.30 - 3025.27$	32.930
$(013) - (001)$	[11, 14, 16]	1.67 ^c	775	$2602.31 - 2724.63$	0.458
$(022) - (010)$	[5, 7, 14]	2	1629	$2603.52 - 2769.44$	1.740
$(111) - (000)$	[14, 16]		3604	$2625.81 - 3050.15$	250.900
$(112) - (001)$	[11, 14, 16]	2.29 ^c	1432	$2630.87 - 2719.79$	4.446
$(111) - (000)$ ^a	[26, 27, 28]		1300	$2653.74 - 2739.29$	0.452
$(112) - (100)$	[11, 14, 16]	1	68	$2658.87 - 2717.11$	0.025
$(131) - (020)$	[12, 14, 23]	3	899	$2666.65 - 2741.00$	0.834
$(221) - (110)$	[14, 17, 24]	2	311	$2673.12 - 2727.24$	0.103
$(121) - (010)$	[5, 7, 17]	2	1851	$2678.75 - 2774.42$	16.590
$(211) - (100)$	[9, 14, 16]	2	1242	$2681.75 - 2764.15$	2.540
$(111) - (000)$ ^b	[26, 27, 28]		2337	$2694.17 - 2767.87$	1.023
$(210) - (000)$	[14, 16]		3327	$2703.94 - 3156.28$	8.116
$(211) - (001)$	[9, 14, 16]	1	48	$2713.93 - 2767.58$	0.014
$(013) - (010)$	[5, 11, 14]	1	2459	$2889.23 - 3090.28$	47.350

Region( ${cm}^{- 1}$ )	Intensities Sum	%H ^a	NC	NH	Region( ${cm}^{- 1}$ )	Intensities sum	%H ^a	NC	NH
2500–2500	$6.46 E - 23$	2.1	135	40	2750–2760	$2.68 E - 21$	12.5	351	701
2510–2520	$4.04 E - 23$	3.0	150	36	2760–2770	$4.62 E - 21$	12.3	469	603
2520–2530	$1.83 E - 23$	6.1	85	36	2770–2780	$4.14 E - 21$	4.4	703	386
2530–2540	$1.76 E - 23$	5.9	87	38	2780–2790	$3.70 E - 21$	0.0	577	0
2540–2550	$1.47 E - 23$	10.1	55	51	2790–2800	$7.37 E - 21$	0.0	605	0
2550–2560	$1.33 E - 23$	18.9	59	53	2800–2810	$3.42 E - 21$	0.0	896	0
2560–2570	$1.24 E - 23$	35.8	56	63	2810–2820	$2.90 E - 23$	0.0	205	0
2570–2580	$1.10 E - 23$	51.5	46	64	2820–2830	$3.62 E - 23$	0.0	264	0
2580–2590	$9.97 E - 24$	64.3	43	108	2830–2840	$4.48 E - 23$	0.0	259	0
2590–2600	$7.43 E - 24$	64.2	56	121	2840–2850	$6.51 E - 23$	1.8	238	9
2600–2610	$1.79 E - 23$	83.9	83	230	2850–2860	$9.41 E - 23$	6.7	224	39
2610–2620	$7.02 E - 24$	29.5	112	73	2860–2870	$1.07 E - 22$	14.7	190	57
2620–2630	$1.23 E - 23$	30.9	119	111	2870–2880	$9.11 E - 23$	30.8	196	69
2630–2640	$2.35 E - 23$	34.2	157	208	2880–2890	$1.12 E - 22$	48.0	199	124
2640-2650	$3.88 E - 23$	35.8	178	252	2890–2900	$1.36 E - 22$	65.3	195	243
2650–2660	$6.69 E - 23$	34.9	233	259	2900–2910	$2.28 E - 22$	61.0	238	325
2660–2670	$1.21 E - 22$	45.9	239	410	2910–2920	$2.82 E - 22$	70.3	272	410
2670–2680	$1.72 E - 22$	45.7	250	413	2920–2930	$5.47 E - 22$	92.0	316	564
2680–2690	$2.21 E - 22$	42.1	265	463	2930–2940	$5.07 E - 22$	90.9	276	282
2690–2700	$2.87 E - 22$	40.2	332	874	2940–2950	$6.89 E - 22$	87.5	326	414
2700–2710	$3.60 E - 22$	49.0	324	628	2950–2960	$8.22 E - 22$	78.1	324	545
2710–2720	$4.31 E - 22$	47.5	347	907	2960–2970	$1.69 E - 21$	76.2	350	643
2720–2730	$4.77 E - 22$	42.9	370	598	2970–2980	$2.13 E - 21$	54.1	383	576
2730–2740	$1.42 E - 21$	22.5	440	697	2980–2990	$2.93 E - 21$	26.1	455	436
2740–2750	$1.48 E - 21$	19.4	336	654	2990–3000	$5.09 E - 21$	12.4	530	577

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