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GEISA 2003


 

The GEISA 2003 sub-database on line transition parameters
Details of changes since the 1997 edition of GEISA


The molecule names and their corresponding identification codes are in the two first columns of the table: in red are molecules updated in the 2003 edition of GEISA with more entries. and, in blue, are molecules updated with less (suppression of duplicated information). The following columns give respectively: the number of entries in GEISA-97, GEISA 2003 and the difference in contents between both editions, for each molecule.


Molecule

ID.

GEISA 1997 :
# entries

GEISA 2003 :
# entries

Difference :
# entries

H2O

1

50,217

58,726

8,509

CO2

2

62,816

76,826

14,010

O3

3

281,607

319,248

37,641

N2O

4

26,771

26,681

-90

CO

5

13,515

13,515

0

CH4

6

66,883

216,196

149,313

O2

7

6,292

6,290

-2

NO

8

94,738

99,123

4,385

SO2

9

38,853

38,853

0

NO2

10

100,680

104,224

3,544

NH3

11

11,152

29,082

17,930

PH3

12

4,635

11,740

7,105

HNO3

13

171,504

171,504

0

OH

14

41,786

42,866

1,080

HF

15

107

107

0

HCl

16

533

533

0

HBr

17

576

1,294

718

HI

18

237

806

569

ClO

19

7,230

7,230

0

OCS

20

24,922

24,922

0

H2CO

21

2,702

2,701

-1

C2H6

22

14,981

14,981

0

CH3D

23

11,524

35,518

23,994

C2H2

24

1,668

3,115

1,447

C2H4

25

12,978

12,978

0

GeH4

26

824

824

0

HCN

27

2,775

2,550

-225

C3H8

28

9019

8983

-36

C2N2

29

2,577

2,577

0

C4H2

30

1,405

1,405

0

HC3N

31

2,027

2,027

0

HOCl

32

15,565

17,862

2297

N2

33

117

120

3

CH3Cl

34

9,355

18,344

8,989

H2O2

35

100781

100781

0

H2S

36

20,788

20,788

0

HCOOH

37

3,388

3,388

0

COF2

38

54,866

83,750

28,884

SF6

39

11,520

11,520

0

C3H4

40

3,390

3,390

0

HO2

41

26,963

38,804

11,841

ClONO2

42

32,199

32,199

0

Total lines :

1,346,466

1,668,371

+ 321,905


 
 

H2O :
Three spectral regions have been re-investigated. In the 500 to 2,850 cm-1 region, the line parameters were replaced with a compilation of 10,755 water transitions obtained by Toth (1998, 1999, 2000) and Toth et al. (1998). In the 9,650-11,400 cm-1 region, the update comes from of empirical line parameters of H216O obtained by Brown et al. (2002). In the 13,000-26,000 cm-1 region the new line parameters are from Carleer et al. (1999), Coheur et al. (2002) and Fally et al. (2003).
In the 10 μm region, alternative line parameters, from Stewart (2003), have been issued has a support study for IASI, and archived in GEISA 2003 as an alternative line list for H2O.
 
  CO2 :
The previous line parameters of the transitions belonging to the four most abundant isotopomers 12C16O2, 13C16O2, 16O12C18O and 16O12C17O in the 442-2,797 cm-1 spectral region, have been replaced with 48,627 new ones covering the 436-2,826 cm-1 spectral range, issued of the results described in Tashkun et al. (1998, 2001) and Teffo et al. (2002, 2003).
 
  O3 :
Updates occur in four spectral regions: In the 600-1,232 cm-1 spectral region, new and more accurate line parameters for the ν1 and ν3 bands of 16O3 were derived by Wagner et al. (2002) and Flaud et al. (2003). A complete new study of the 1,300-1,500 cm-1 spectral range, related with the 2ν2, 3ν22, ν13 3 2 and 2ν 3 2 bands of 16O3, has been made by Barbe et al. (1998). The 1,820-2,260 cm-1 (2ν3, ν13 and 2 ν13 interactive bands of 16O18O16O) and the 2,600-2,900 cm-1 (triad: ν2+2ν3, ν123 with 2ν12) regions, have been reinvestigated by De Backer-Barilly et al. (2003) and by Mikhaïlenko et al. (2002), respectively.
 
  N2O :
279 lines in the spectral region 870-1,240 cm-1, recently revisited by Daumont et al. (2002), have been substituted in two bands, ν31 and ν3-2ν2, the intensities of which were doubtful. In addition, a technical update has removed 118 duplicated lines in the spectral interval 564 cm-1 - 629 cm-1.
 
  CH4 and CH3D :
The CH4 and CH3D contents of GEISA have been extensively updated. The spectral range has been extended from 6,184.492 cm-1 to 9,199.2846 cm-1, and the number of entries increased from 66,883 to 216,196 (weaker transitions of 12CH4 and new bands of 13CH4 and CH3D included). Full details about the revision in the spectral interval from 0.01 to 6,184.492 cm-1 can be found in a review paper by Brown et al. (2003). The new CH4 near infrared data from 4,800-5,500 cm-1 and 6,180-10,000 cm-1 are from an empirical list obtained by Brown (2003), from a few selected FTS laboratory spectra.
 
  O2 :
The two spectral regions, 7,664.726-8,064.311 cm-1 and 11,483.727-15,927.806 cm-1, have been updated thanks to new results by Goldman et al. (2003) and by Brown and Plymate (2000), respectively.
 
  NO :
A new line list has been produced (Goldman 2003) in the first overtone region of the main isotopic species 14N16O, i.e. between 3,547.318 and 3,799.155 cm-1. This calculation has been issued from experimental data from Mandin et al. (1997,1998) and theoretical results from Gillis and Goldman (1982).
 
  NO2 :
A new linelist was set up in the spectral region of the ν13, ν1+2ν2 and ν1232 bands of the 14N16O2 main isotopic species. New line parameters come from the works of Mandin et al. (1997), Dana et al. (1997), Devi et al. (1982), May and Webster (1990).
 
  NH3 :
The line parameters of the interval 0.058-5,294.502 cm-1 have been totally replaced by those issued by Kleiner and Brown (2003) and described in Kleiner et al. (2003).
 
  PH3 :
New data from Brown and Kleiner (2003), described in Kleiner et al. (2003), have replaced the whole content of the region from 770.877 to 2,478.765 cm-1.
 
  OH :
Line parameters in the ultraviolet region from 29,808.500 to 35,877.030 cm-1 , from Gillis et al. (2001) have been added to the GEISA archive.
 
  HBr :
New line parameters of H79Br and H81Br, for the spectral regions of the pure rotation band X1Σ+ (0-0) (16.692-396.474 cm-1) and of the fundamental band (1-0) (2,123.812-2,790.533 cm-1), have been derived for spectroscopic databases update, as described in Goldman et al. (2003).
 
  HI :
The description of the updates in the spectral regions of the X1Σ+ (0-0) (12.842-319.820 cm-1) and of the (0-1) (1,950.689-2,403.162 cm-1) bands, is given in Goldman et al. (2003).
 
  C2H6 :
In the spectral region 2,975.331-2,977.926 cm-1, a modified list by Rinsland et al. (1998), for the pQ3 sub-branch in the ν7 band, has replaced the previously archived line parameters.
 
  C2H2 :
The updates of the database has concerned three spectral regions: the 13.6- and 5-μm regions, from work performed by Mandin et al. (2000), Jacquemart et al. (2001, 2002), and the 7.5 -μm region, from results by Vander Auwera (2000).
 
  HOCl :
A new line list has been created in the spectral interval 1,178.673-1,320.332 cm-1, corresponding to the ν2 region, on the basis of the works of Flaud et al. (1998), Flaud (2002) and Vander Auwera et al. (2000).
 
  CH3Cl :
In the spectral region from 1,261.562 to 1,645.899 cm-1 , a list of 8,989 transitions of the [ν2, ν5, 2ν3] -vibrational-band triad, prepared by Brown (2002) and based upon the work of Chackerian et al. (1998), has been newly archived, for CH335Cl and CH337Cl.
 
  COF2 :
An update of the 1,856.730-2,001.348 cm-1 region has been made thanks to a list generated by Brown (2001), based on an unpublished analysis of the line positions.
 
  HO2 :
Spectroscopic parameters for the ground state have replaced by those generated upon the basis of the work of Chance (1997, 2003)).

REFERENCES