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The GEISA 2011 sub-database on line transition parameters
GEISA 2011 format for line transition parameters


 

Illustration of the format used for the line transition parameters archive in the 2011 edition of GEISA :

This format includes 31 spectroscopic line parameters representing 252 characters record per entry. The spectroscopic line parameters are listed in the 31 columns of the first line of Table -1- and their description is given below. For each parameter, the field length and the FORTAN format descriptor are given in lines 2 and 3, with associated counting of the records (in blue) in lines 4 and 5, Some modifications have been brought to the GEISA 2003 format , i.e.:

- Lengths of fields E1, E2, E3, E4, N, O, N’, O', have been extended (high-lightened in pale red)
- Fields P and Q have been suppressed (related with non GEISA references)
- Standard default values have been adopted for each parameter and for the whole database as described .
It has to be noticed that:
- Fields K and L (high-lightened in grey) are HITRAN specific for the users’ easier possible interface between the two databases.
- Value in field M is given only if directly provided by the author of the spectroscopic line entry.


Table -1-

Parameter A B C D E1 E2 E3 E4 F G I J
Field length 12 11 6 10 25 25 15 15 4 3 3 3
Fortran descriptor F12.6 1PD11.4 0PF6.4 F10.4 A25 A25 A15 A15 F4.2 I3 I3 A3
Undefined values -0.999999 -9.9999D-01 -.9999 -0.9999 * * * * -.99 -99 -99 *
Record counting 12 23 29 39 64 89 104 119 123 126 129 132

 
K L M N O R A' B' C' F'
2 1 10 7 9 6 10 11 6 4
I2 I1 1PE10.3 0PF7.4 F9.6 F6.4 F10.6 1PD11.4 0PF6.4 F4.2
-9 0 -9.999E-01 -9.9999 0.000000 -.9999 -0.999999 -9.9999D-01 -.9999 -.99
134 135 145 152 161 167 177 188 194 198

 
O' R' N' S S' T T' U U'
9 6 7 4 4 8 8 4 4
F9.6 F6.4 F7.4 F4.2 F4.2 F8.6 F8.6 F4.2 F4.2
-9.999999 -.9999 -9.9999 -.99 -.99 -.999999 -.999999 -.99 -.99
207 213 220 224 228 236 244 248 252

A : wavenumber (cm-1) of the line
B : intensity of the line in (cm-1/(molecule.cm-2) at 296K
C : Air broadening pressure halfwidth (HWHM) (cm-1atm-1) at 296K
D : Energy of the lower transition level (cm-1)
Ei (i=1,2,3,4) : Transition quantum identifications for the lower and upper state of the transition
    E1 : upper state vibrational identification  E2 : lower state vibrational identification
    E3 : upper state rotationnal identification  E4 : lower state rotationnal identification
F : temperature dependence coefficient n of the air broadening halfwidth
G : identification code for isotopologue as in GEISA
I : identification code for molecule as in GEISA
J : Internal GEISA code for the data identification
K : Molecule number as in HITRAN
L : isotopologue number (1=most abundant, 2= second...etc) as in HITRAN
M : Einstein A-coefficient
N : self broadening pressure halfwidth (HWHMself) (cm-1atm-1) at 296K
O : air pressure shift of the line transition (cm-1atm-1) at 296K
R : temperature dependence coefficient of the air pressure shift
A' : estimated accuracy (cm-1) on the line position
B' : estimated accuracy on the intensity of the line in (cm-1/(molecule.cm-2)
C' : estimated accuracy on the air collision halfwidth (HWHM) (cm-1atm-1)
F' : estimated accuracy on the temperature dependence coefficient of the air broadening halfwidth
O' : estimated accuracy on the air pressure shift of the line transition (cm-1atm-1) at 296K
R' : estimated accuracy on the temperature dependence coefficient of the air pressure shift
N' : estimated accuracy on the self broadened (HWHM) (cm-1atm-1) at 296K
S : temperature dependence coefficient of the self broadening halfwidth
S' : estimated accuracy on the temperature dependence coefficient of the self broadening halfwidth
T : self pressure shift of the line transition (cm-1atm-1) at 296K
T' : estimated accuracy on the self pressure shift of the line transition (cm-1atm-1) at 296K
U : temperature dependence coefficient of the self pressure shift
U' : estimated accuracy on the temperature dependence coefficient of the self pressure shift



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Identification of vibrational quantum number implementations in fields E1 and E2:

Please see Table -2- in the attached document for quantum number identification digits in the E1 and E2 fields of the format (positions illustrated by yellow cells) and specific of each molecule (ordered in the GEISA internal molecule numbering). The illustration corresponds to the possible maximum number of digits, for a given transition.

In case of non identified vibrational transitions, an additional line format description, with all of its 25 cells in grey colour, has been added.

See section “Overall description of available vibrational transitions” for detailed lists, per molecule, of vibrational transitions and associated complementary information.

Those descriptions are intended to facilitate the use of the Transition Analysis option in the “database access” section.