Morphing radial molecular property functions of hydroxyl
The result's identifiers
Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388963%3A_____%2F20%3A00531250" target="_blank" >RIV/61388963:_____/20:00531250 - isvavai.cz</a>
Alternative codes found
RIV/00216208:11320/20:10421566
Result on the web
<a href="https://www.sciencedirect.com/science/article/pii/S0022407320304337?via%3Dihub" target="_blank" >https://www.sciencedirect.com/science/article/pii/S0022407320304337?via%3Dihub</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1016/j.jqsrt.2020.107211" target="_blank" >10.1016/j.jqsrt.2020.107211</a>
Alternative languages
Result language
angličtina
Original language name
Morphing radial molecular property functions of hydroxyl
Original language description
Effective (mass-dependent) potential energy curves of the X2Π ground electronic states of isotopomers of the hydroxyl radical OH are constructed by morphing literature RKR and ab initio potential energy curves within the framework of the reduced potential energy curve (RPC) approach of Jenč. The morphing is performed by fitting the RPC parameters to available experimental ro-vibrational data. In turn, the resulting potential energy curves are used to determine the radial property functions describing the spin-rotation and fine and hyperfine energy patterns of the spin-ro-vibrational energy levels by morphing their RKR and ab initio approximants. The resulting functions enable reliable prediction for untested spectral regions on the one hand and quantitative testing of the impacts of external fields on the observed spectral transitions on the other.
Czech name
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Czech description
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Classification
Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
10403 - Physical chemistry
Result continuities
Project
<a href="/en/project/GA18-00918S" target="_blank" >GA18-00918S: Quantum Dynamics of Astrophysically Important Molecules</a><br>
Continuities
I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace
Others
Publication year
2020
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů
Data specific for result type
Name of the periodical
Journal of Quantitative Spectroscopy and Radiative Transfer
ISSN
0022-4073
e-ISSN
—
Volume of the periodical
254
Issue of the periodical within the volume
Oct
Country of publishing house
GB - UNITED KINGDOM
Number of pages
8
Pages from-to
107211
UT code for WoS article
000574830100010
EID of the result in the Scopus database
2-s2.0-85087975373