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A new linelist for the A3Π–X3Σ− transition of the NH free radical
- Source :
- Journal of Quantitative Spectroscopy and Radiative Transfer. 217:29-34
- Publication Year :
- 2018
- Publisher :
- Elsevier BV, 2018.
-
Abstract
- A new linelist for the A3Π– X 3 Σ − electronic transition of NH has been prepared using line positions from the literature and calculated line intensities. High level ab initio calculations were performed with the MOLPRO program to obtain the A–X transition dipole moment function. Potential energy curves and line strengths were calculated with Le Roy’s RKR1 and LEVEL programs. Line intensities and Einstein A values were calculated with Western’s PGOPHER program after converting the Hund’s case (b) output of LEVEL to Hund’s case (a) input needed for PGOPHER . The Herman–Wallis effect is included in the Einstein A calculations of the bands for the levels with v ′ = 0 − 2 and v ″ = 0 − 6 .
- Subjects :
- Physics
Radiation
010504 meteorology & atmospheric sciences
Transition dipole moment
01 natural sciences
Potential energy
Atomic and Molecular Physics, and Optics
Molecular electronic transition
Ab initio quantum chemistry methods
0103 physical sciences
A value
Atomic physics
010303 astronomy & astrophysics
Spectroscopy
0105 earth and related environmental sciences
Line (formation)
Subjects
Details
- ISSN :
- 00224073
- Volume :
- 217
- Database :
- OpenAIRE
- Journal :
- Journal of Quantitative Spectroscopy and Radiative Transfer
- Accession number :
- edsair.doi...........2b46b7ad5e50b64cee7ae6e49a929c38
- Full Text :
- https://doi.org/10.1016/j.jqsrt.2018.05.021