Metadata

• cis-31P2-1H2__OY-Cis.def: "Definitions" file (text format).
• cis-31P2-1H2__OY-Cis.def.json: "Definitions" file (JSON format).

Spectroscopic Model

OY-Cis: line list

OY-Cis ro-vibrational line list for cis-P2H2

Show files

References

1. Owens, A., Yurchenko, S. N., "Theoretical rotation-vibration spectroscopy of cis- and trans-diphosphene (P₂H₂) and the deuterated species P₂HD", Journal of Chemical Physics 150, 194308/1-9 (2019). [link to article][19OwYuxx.P2H2]

OY-Cis: partition function

OY-Cis ro-vibrational line list for cis-P2H2

• cis-31P2-1H2__OY-Cis.pf
  Partition function produced using the Cis-(31P)2(1H)2 line list.

References

1. Owens, A., Yurchenko, S. N., "Theoretical rotation-vibration spectroscopy of cis- and trans-diphosphene (P₂H₂) and the deuterated species P₂HD", Journal of Chemical Physics 150, 194308/1-9 (2019). [link to article][19OwYuxx.P2H2]

OY-Cis: opacity

OY-Cis ro-vibrational line list for cis-P2H2

• cis-31P2-1H2__OY-Cis.R1000_0.3-50mu.ktable.ARCiS.fits.gz
  ARCiS k-tables at R= 1000 (0.3-50mu) in fits format (gzipped): OY-Cis (31P)2(1H)2 line list.
• cis-31P2-1H2__OY-Cis.R1000_0.3-50mu.ktable.NEMESIS.kta
  NEMESIS k-tables at R= 1000 (0.3-50mu) in NEMESIS-kta format: OY-Cis (31P)2(1H)2 line list.
• cis-31P2-1H2__OY-Cis.R15000_0.3-50mu.xsec.TauREx.h5
  TauREx k-tables at R= 15000 (0.3-50mu) in HDF5 format: OY-Cis (31P)2(1H)2 line list.
• cis-31P2-1H2__OY-Cis.R1000_0.3-50mu.ktable.petitRADTRANS.h5
  petitRADTRANS k-tables at R= 1000 (0.3-50mu) in HDF5 format: OY-Cis (31P)2(1H)2 line list.

References

1. Owens, A., Yurchenko, S. N., "Theoretical rotation-vibration spectroscopy of cis- and trans-diphosphene (P₂H₂) and the deuterated species P₂HD", Journal of Chemical Physics 150, 194308/1-9 (2019). [link to article][19OwYuxx.P2H2]
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). [link to article][20ChRoYu.]

OY-Cis: Specific heat - heat capacity

OY-Cis ro-vibrational line list for cis-P2H2

• cis-31P2-1H2__OY-Cis.cp
  Heat capacity (specific heat) Cp of cis-(31P)2(1H)2 in 200 K intervals to 1000 K

References

1. Owens, A., Yurchenko, S. N., "Theoretical rotation-vibration spectroscopy of cis- and trans-diphosphene (P₂H₂) and the deuterated species P₂HD", Journal of Chemical Physics 150, 194308/1-9 (2019). [link to article][19OwYuxx.P2H2]

OY-Cis: broadening coefficients

OY-Cis ro-vibrational line list for cis-P2H2

References