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Source: Physical Review A. 2016. Vol. 94, № 4. P. 042514-1-042514-15
Type: статьи в журналах
Date: 2016
Description:
Energies and lifetimes (widths) of vibrational states above the lowest dissociation limit of O316 were determined using a previously developed efficient approach, which combines hyperspherical coordin
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Source: Journal of Chemical Physics. 2016. Vol. 145, № 11. P. 114309-1-114309-16
Type: статьи в журналах
Date: 2016
Description:
Full 9-dimensional ab initio potential energy surfaces for the methane molecule are constructed using extended electronic structure coupled-cluster calculations with various series of basis sets follo
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Source: Astronomy and astrophysics. 2016. Vol. 594. P. A47 (1-16)
Type: статьи в журналах
Date: 2016
Description:
We present the construction of complete and comprehensive ethylene line lists for the temperatures 50−700 K based on accurate ab initio potential and dipole moment surfaces and extensive first-princip
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Source: Journal of molecular spectroscopy. 2016. Vol. 327. P. 138-158
Type: статьи в журналах
Date: 2016
Description:
Knowledge of intensities of rovibrational transitions of various molecules and theirs isotopic species in wide spectral and temperature ranges is essential for the modeling of optical properties of pl
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Source: The Journal of Physical Chemistry A. 2016. Vol. 120, № 45. P. 8983-8997
Type: статьи в журналах
Date: 2016
Description:
Nine-dimensional potential energy surface (PES) and dipole moment surface (DMS) of the germane molecule are constructed using extended ab initio CCSD(T) calculations at 19 882 points. PES analytical r
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Authors:
Campargue, Alain |
Zbiri, Y. |
Mondelain, Didier |
Kassi, Samir |
Karlovets, Ekaterina Vladimirovna |
Nikitin, Andrei V. |
Rey, Michaël |
Starikova, Evgeniya N. |
Tyuterev, Vladimir G. |
Béguier, S.
Source: Journal of molecular spectroscopy. 2016. Vol. 326. P. 115-121
Type: статьи в журналах
Date: 2016
Description:
The 13CH4 absorption spectrum has been recorded at 296 K and 80 K in the Icosad range between 6600 and 7700 cm−1. The achieved noise equivalent absorption of the spectra recorded by differential absor
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Source: Physical chemistry chemical physics. 2016. Vol. 18, № 1. P. 176-189
Type: статьи в журналах
Date: 2016
Description:
A detailed study of methane spectra in the highly congested icosad range of 6280–7800 cm−1 has been performed using global variational calculations derived from accurate ab initio potential energy and
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Source: Journal of Quantitative Spectroscopy and Radiative Transfer. 2016. Vol. 168. P. 207-216
Type: статьи в журналах
Date: 2016
Description:
Accurate rovibrational analysis of the lower part of the Icosad 12CH4 spectrum in the 6539–6800 cm−1 region is reported. The analysis uses the WKLMC experimental line list previously obtained in Greno
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Source: Journal of Quantitative Spectroscopy and Radiative Transfer. 2016. Vol. 174. P. 88-100
Type: статьи в журналах
Date: 2016
Description:
A new study of 13CH4 line intensities and positions was performed in the Octad region between 3750 and 4700 cm−1. Using 13C-enriched samples, spectra were recorded with both the McMath–Pierce FTS at K
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