Deuterium enriched water vapor Fourier Transform Spectroscopy: the 8800-10800 cm -1 spectral region....
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Transcript of Deuterium enriched water vapor Fourier Transform Spectroscopy: the 8800-10800 cm -1 spectral region....
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Deuterium enriched water vapor Fourier Transform Spectroscopy: the 8800-10800 cm-1 spectral region.(1) L. Daumont, (1) A. Jenouvrier, (2)S. Fally, (3) C. Hermans, (2) A. C. Vandaele and (2) M. CarleerUniversit de Reims Champagne-Ardenne, Groupe de Spectromtrie Molculaire et Atmosphrique, Reims, France.Universit Libre de Bruxelles, Service de Chimie Quantique et Photophysique, Brussels (ULB-SCQP), Belgium.Belgian Institute for Space Aeronomy (BIRA-IASB), Brussels, Belgium.
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Experimental setupThe 50 meter base long multipass cellBRUKER IFS 120 MspectrometerDetector: Si DiodeQuartz beamsplitter Stabilized W lampWater vapor:
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HODD2OHITRAN 2004ICLAS + ICLAS-VeCSELFTSFTSFTSPrevious studies: Positions (and assignements)IntensitiesFTS+ ICLAS-VeCSELFTSFTS+ICLASFTSFTSFTSPresent Work
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HITRAN 2004Band Centers (cm-1)Band integrated absorption cross sections S(296K) cm-1/(molec/cm-2)HODH217OH218OH216O
7513 cm-1
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Raw spectra for different H2O/HDO/D2O mixturesSpecies identification Ptot = PH2O + PHDO + PD2O - PH2O from BR list - PHDO and PD2O : (a)- Equilibrium constant (Pred: Appl. Spectrosc. 49 (10) (1995)1431-1437) (b)- Mean ratios of the measured line areas in the spectra B and C. Partial pressures Species HDOD2O Nbr of measured lines 59212462 Nbr of assignments 69432661 Nbr of unassigned lines 210 221Line parametersAssignments and partial pressures
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422Ka01234541441331431533321423523313413515303505Term values0 0 30 0 0Example of Ritz energy difference: from the 33 422 (cm-1)5515
Graph1
91.335800
100.39433
157.06602
233.01919
182.99196
217.04645
2
295.67706
402.32062
221.95716
225.87499
304.00556
373.67037
480.25579
615.95496
Feuil1
JKaKc000003JKaKc000003
000010631.91512
10115.5088710647.15429
11129.8080510658.46338
11032.4960710661.35597
20246.175510677.13675
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330233.0467110837.66044
404150.163910777.64525
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413182.99196413182.9919610809.86404
423217.04645423217.0464510834.62147
42210841.15374800422221.8416310841.15374
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441402.32062441402.3206210986.15972
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-
Example of HDO subband of 1+2 3 :
obs-calc (cm-1)1024 x S (cm molec-1)Average: 0.95
-
Contributions of the different speciesIntegrated absorption cross sectionscm-1/(molec/cm-2) (293 K)Natural H2OD2OHDO
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D2O: the 31+3 bandPositions obs = This work and Ulenikov* Absolute intensitiesSelf-broadening coefficientsComparison between observed and calculatedMean ratio: 1.03Wavenumbers (cm-1)obs-PS (cm-1)Kmax + 0.04 Jmaxself (cm-1/atm)Wavenumbers (cm-1)* Ulenikov JMS 210, 18 (2001)
Graph1
0.3156025704
0.6173438981
0.9940772901
0.3345419967
1.6899348059
0.5744949792
1.2575144523
1.1589537211
1.1741479867
1.589463963
0.903703764
0.9340993286
1.5747405082
0.9902273897
0
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1.1645416507
0.9232278408
1.3040720903
1.0171254557
0
0
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1.0070359632
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1.0094721608
0.7615533774
0.9762932997
1.0799405397
1.0719681261
1.0535633211
1.2011113348
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Graph2
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Mean ratio I obs/I calc = 1.033
301 Band
Graph2 (2)
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Graph3
0.3694487038
0.5816819398
0.3233951651
0.3226080281
1.56
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1.48
2.48
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6.32
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1.44
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5.32
0.8519449866
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0.7517911599
1.4
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1.36
1.0243978759
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0.7533193854
5.24
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4.24
1.0692655729
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2.28
2.12
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1.24
0.6976660311
0.8837068095
0.7683526756
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8.36
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0.7023068807
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7.36
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3.16
0.9353897288
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6.36
0.7070797176
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7.28
5.4
6.32
6.32
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0.890894994
0.7152458971
0.6629059449
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0.7465338754
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5.32
1.1102491099
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6.24
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0.5970324423
0.5519411399
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Dn (obs-calc) (cm-1)
Graph4 (2)
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