ExoMol

Part of EU Open Research Repository
Published May 1, 2019 | Version 20190501
Dataset Open

The AYYJ dataset for 12C1H3

Authors/Creators

  • 1. University College London
  • 2. SRON Netherlands Institute for Space Research
  • 3. Max Planck Institute for Astronomy

Description

The dataset is an archive of ExoMol page, https://exomol.com/data/molecules/CH3/12C-1H3/AYYJ.
Please check the reference details according to the following description or directly from the website.
NB: The html description skips data which are not included in the current version for the purpose of simplicity. Please check CH3_12C1H3_AYYJ.md for detailed information.

Definitions file

12C-1H3__AYYJ.def[11.78 KB]

References:
1. Tennyson, J., Yurchenko, S. N., Al-Refaie, A. F., Clark, V. H. J., Chubb, K. L., Conway, E. K., Dewan, A., Gorman, M. N., Hill, C., Lynas-Gray, A. E., Mellor, T., McKemmish, L. K., Owens, A., Polyansky, O. L., Semenov, M., Somogyi, W., Tinetti, G., Upadhyay, A., Waldmann, I., Wang, Y., Wright, S., Yurchenko, O. P., "The 2020 release of the ExoMol database: molecular line lists for exoplanet and other hot atmospheres", J. Quant. Spectrosc. Rad. Transf., 255, 107228 (2020). [https://doi.org/10.1016/j.jqsrt.2020.107228]

Spectroscopic Model

https://exomol.com/models/CH3/12C-1H3/AYYJ/

AYYJ: line list

A semi-empirical line list for CH3.

12C-1H3__AYYJ__00000-01000.trans.bz2[246.15 MB]
The AYYJ line list for (12C)(1H)3: Transitions file for 0-1000 cm-1.

12C-1H3__AYYJ__01000-02000.trans.bz2[374.21 MB]
The AYYJ line list for (12C)(1H)3: Transitions file for 1000-2000 cm-1.

12C-1H3__AYYJ__02000-03000.trans.bz2[553.08 MB]
The AYYJ line list for (12C)(1H)3: Transitions file for 2000-3000 cm-1.

12C-1H3__AYYJ__03000-04000.trans.bz2[789.81 MB]
The AYYJ line list for (12C)(1H)3: Transitions file for 3000-4000 cm-1.

12C-1H3__AYYJ__04000-05000.trans.bz2[1.08 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 4000-5000 cm-1.

12C-1H3__AYYJ__05000-06000.trans.bz2[1.48 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 5000-6000 cm-1.

12C-1H3__AYYJ__06000-07000.trans.bz2[1.98 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 6000-7000 cm-1.

12C-1H3__AYYJ__07000-08000.trans.bz2[2.61 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 7000-8000 cm-1.

12C-1H3__AYYJ.states.bz2[82.05 MB]
The AYYJ line list for (12C)(1H)3: State file.

12C-1H3__AYYJ__08000-09000.trans.bz2[3.37 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 8000-9000 cm-1.

12C-1H3__AYYJ__09000-10000.trans.bz2[4.26 GB]
The AYYJ line list for (12C)(1H)3: Transitions file for 9000-10000 cm-1.

References:
1. Adam, A. Y., Yachmenev, A., Yurchenko, S. N., Jensen, P., "Variationally Computed IR Line List for the Methyl Radical CH3", The Journal of Physical Chemistry A 123, 4755-4763 (2019). [https://pubs.acs.org/doi/10.1021/acs.jpca.9b02919][16AdYaYu.CH3]

AYYJ: partition function

A semi-empirical line list for CH3.

12C-1H3__AYYJ.pf[48.83 KB]
The AYYJ line list for (12C)(1H)3: Partition function.

References:
1. Adam, A. Y., Yachmenev, A., Yurchenko, S. N., Jensen, P., "Variationally Computed IR Line List for the Methyl Radical CH3", The Journal of Physical Chemistry A 123, 4755-4763 (2019). [https://pubs.acs.org/doi/10.1021/acs.jpca.9b02919][16AdYaYu.CH3]

AYYJ: opacity

A semi-empirical line list for CH3.

12C-1H3__AYYJ.R1000_0.3-50mu.ktable.ARCiS.fits.gz[337.56 MB]
ARCiS k-tables at R= 1000 (0.3-50mu) in fits format (gzipped): AYYJ (12C)(1H)3 line list.

12C-1H3__AYYJ.R1000_0.3-50mu.ktable.petitRADTRANS.h5[370.98 MB]
petitRADTRANS k-tables at R= 1000 (0.3-50mu) in HDF5 format: AYYJ (12C)(1H)3 line list.

12C-1H3__AYYJ.R1000_0.3-50mu.ktable.NEMESIS.kta[232.01 MB]
NEMESIS k-tables at R= 1000 (0.3-50mu) in NEMESIS-kta format: AYYJ (12C)(1H)3 line list.

12C-1H3__AYYJ.R15000_0.3-50mu.xsec.TauREx.h5[348.39 MB]
TauREx k-tables at R= 15000 (0.3-50mu) in HDF5 format: AYYJ (12C)(1H)3 line list.

References:
1. Adam, A. Y., Yachmenev, A., Yurchenko, S. N., Jensen, P., "Variationally Computed IR Line List for the Methyl Radical CH3", The Journal of Physical Chemistry A 123, 4755-4763 (2019). [https://pubs.acs.org/doi/10.1021/acs.jpca.9b02919][16AdYaYu.CH3]
2. Chubb, K. L., Rocchetto, M., Yurchenko, S. N., Min, M., Waldmann, I., Barstow, J. K., Molliere, P., Al-Refaie, A. F, Phillips, M. W., Tennyson, J., "The ExoMolOP database: Cross sections and k-tables for molecules of interest in high-temperature exoplanet atmospheres", Astronomy and Astrophysics 646, A21 (2020). [http://dx.doi.org/10.1051/0004-6361/202038350][20ChRoYu.]

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CH3_12C1H3_AYYJ.md

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Additional details

Funding

European Commission
ExoplANETS A - Exoplanet Athmosphere New Emission Transmission Spectra Analysis 776403
UK Research and Innovation
UCL Astrophysics Consolidated Grant 2018-2021 ST/R000476/1
European Commission
ExoMolHD - ExoMolHD: Precision spectroscopic data for studies of exoplanets and other hot atmospheres 883830
European Commission
EXOMOL - ExoMol: molecular line lists for exoplanet atmospheres 267219

References

  • Tennyson, J., Yurchenko, S. N., Al-Refaie, A. F., Clark, V. H. J., Chubb, K. L., Conway, E. K., Dewan, A., Gorman, M. N., Hill, C., Lynas-Gray, A. E., Mellor, T., McKemmish, L. K., Owens, A., Polyansky, O. L., Semenov, M., Somogyi, W., Tinetti, G., Upadhyay, A., Waldmann, I., Wang, Y., Wright, S., Yurchenko, O. P., "The 2020 release of the ExoMol database: molecular line lists for exoplanet and other hot atmospheres", J. Quant. Spectrosc. Rad. Transf., 255, 107228 (2020). \[[https://doi.org/10.1016/j.jqsrt.2020.107228](https://doi.org/10.1016/j.jqsrt.2020.107228)\]
  • Adam, A. Y., Yachmenev, A., Yurchenko, S. N., Jensen, P., "Variationally Computed IR Line List for the Methyl Radical CH3", The Journal of Physical Chemistry A 123, 4755-4763 (2019). [https://pubs.acs.org/doi/10.1021/acs.jpca.9b02919][16AdYaYu.CH3]
  • Chubb, K. L., Rocchetto, M., Yurchenko, S. N., Min, M., Waldmann, I., Barstow, J. K., Molliere, P., Al-Refaie, A. F, Phillips, M. W., Tennyson, J., "The ExoMolOP database: Cross sections and k-tables for molecules of interest in high-temperature exoplanet atmospheres", Astronomy and Astrophysics 646, A21 (2020). [http://dx.doi.org/10.1051/0004-6361/202038350][20ChRoYu.]