Metadata

• trans-31P2-1H-2H__OY-Trans.def: "Definitions" file (text format).
• trans-31P2-1H-2H__OY-Trans.def.json: "Definitions" file (JSON format).

Spectroscopic Model

OY-Trans: line list

Trans ro-vibrational line list for trans-P2H2

• trans-31P2-1H2__OY-Trans.states.bz2
  The States file of the Trans-(31P)2(1H)2 line list.
• trans-31P2-1H-2H__OY-Trans__0000-8000.trans.bz2
  Transitions of the Trans-(31P)2(1H)(2H) line list: 0-8000 cm-1.

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-Trans: partition function

Trans ro-vibrational line list for trans-P2H2

• trans-31P2-1H-2H__OY-Trans.pf
  Partition function produced using the Trans-(31P)2(1H)(2D) 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]