/ftp/cats/VI/133
==========================================================================
VI/133 A variationally computed hot NH3 line list - BYTe (Yurchenko+, 2011)
The following files can be converted to FITS (extension .fit or fit.gz)
nh3_0-41.dat a-*.dat
==========================================================================
Query from: http://vizier.cds.unistra.fr/viz-bin/VizieR?-source=VI/133
==========================================================================
ls: cannot access 'ori': Permission denied
drwxr-xr-x 141 cats archive 4096 Sep 6 2023 [Up]
drwxr-xr-x 3 cats archive 8192 Apr 20 2023 [TAR file]
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Beginning of ReadMe :
VI/133 A variationally computed hot NH3 line list - BYTe (Yurchenko+, 2011)
===============================================================================
A variationally computed line list for hot NH3
Yurchenko S.N., Barber R.J., Tennyson J.
<Mon. Not. R. Astron. Soc. XXX, XXXX (2011)>
=2011MNRAS.413.1828Y
===============================================================================
ADC_Keywords: Atomic physics
Keywords: ammonia - line list - BYTe - molecular spectra
Description:
We present 'BYTe' a comprehensive 'hot' line list of ro-vibrational
transitions of ammonia, ^14^NH_3_, in its ground electronic state.
It comprises 1,138,323,351 transitions with frequencies up to
12,000cm^-1^, constructed from 1,373,897 energy levels below
18,000cm^-1^ having J values less than 37. The line list is
sufficiently accurate and complete for high resolution spectroscopy
and atmospheric modelling of astrophysical objects, including brown
dwarfs and exoplanets at temperatures up to 1,500K.
The data are in two parts. The first, nh3_0-41.dat contains a list
of 4,167,360 rovibrational states, ordered by J (max= 41), symmetry
block and energy (in cm^-1^). Only one third of the states (1,373,897)
are within the parameters used for generating transitions (see above),
but all the states are required for computing temperature-dependent
partition functions.
Each state is labelled with: seven normal mode vibrational quantum
numbers; three rotational quantum numbers and the total symmetry
quantum number, Gamma. In addition there are six local mode
vibrational numbers and a local mode vibrational symmetry quantum
numbers, which we include because the basis set used in our
calculations is expressed in terms of these local mode quantum
numbers. Each rovibrational state has a unique number, which is the
number of the row in which it appears in the file. This number is the
means by which the state is related to the second part of the data
system, the transitions files.
Because of their size, the transitions are listed in 120 separate
files, each containing all the transitions in a 100cm^-1^ frequency
range. These and their contents are ordered by increasing frequency.
The name of the file includes the lowest frequency in the range; thus
the a-00500.dat file contains all the transitions in the frequency
range 500-600cm^-1^.
The transition files contain three columns: the reference number in
the energy file of the upper state; that of the lower state; and the
Einstein A coefficient of the transition. The energy file and the
transitions files are zipped, and need to be extracted before use.
There is a Fortran 90 programme, sp_byte.f90 which may be used
to generate synthetic spectra (see sp_byte.txt for details).
Using this, it is possible to generate absorption or emission spectra
in either 'stick' form or else convoluted with a gaussian with the
half-width at half maximum being specified by the user, or with a the
temperature-dependent doppler half-width. Three sample input files for
use with sp_byte.f90 are supplied: "stick300.in", "gauss300.in",
and "sp08900.in" (generates a spectrum for 8900-9000cm^-1^).