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Subpromille Measurements and Calculations of CO (3-0) Overtone Line Intensities.
Phys Rev Lett. 2022 Jul 22;129(4):043002. doi: 10.1103/PhysRevLett.129.043002.
Phys Rev Lett. 2022.
PMID: 35939021
Calculation of rotation-vibration energy levels of the water molecule with near-experimental accuracy based on an ab initio potential energy surface.
Polyansky OL, Ovsyannikov RI, Kyuberis AA, Lodi L, Tennyson J, Zobov NF.
Polyansky OL, et al. Among authors: kyuberis aa.
J Phys Chem A. 2013 Oct 3;117(39):9633-43. doi: 10.1021/jp312343z. Epub 2013 Apr 19.
J Phys Chem A. 2013.
PMID: 23517285
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High Accuracy ab Initio Calculations of Rotational-Vibrational Levels of the HCN/HNC System.
Makhnev VY, Kyuberis AA, Zobov NF, Lodi L, Tennyson J, Polyansky OL.
Makhnev VY, et al. Among authors: kyuberis aa.
J Phys Chem A. 2018 Feb 8;122(5):1326-1343. doi: 10.1021/acs.jpca.7b10483. Epub 2018 Jan 29.
J Phys Chem A. 2018.
PMID: 29251934
Free article.
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High-accuracy water potential energy surface for the calculation of infrared spectra.
Mizus II, Kyuberis AA, Zobov NF, Makhnev VY, Polyansky OL, Tennyson J.
Mizus II, et al. Among authors: kyuberis aa.
Philos Trans A Math Phys Eng Sci. 2018 Mar 13;376(2115):20170149. doi: 10.1098/rsta.2017.0149.
Philos Trans A Math Phys Eng Sci. 2018.
PMID: 29431677
Free PMC article.
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A highly accurate ab initio dipole moment surface for the ground electronic state of water vapour for spectra extending into the ultraviolet.
Conway EK, Kyuberis AA, Polyansky OL, Tennyson J, Zobov NF.
Conway EK, et al. Among authors: kyuberis aa.
J Chem Phys. 2018 Aug 28;149(8):084307. doi: 10.1063/1.5043545.
J Chem Phys. 2018.
PMID: 30193499
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Measurement and calculation of CO (7-0) overtone line intensities.
Balashov AA, Bielska K, Li G, Kyuberis AA, Wójtewicz S, Domysławska J, Ciuryło R, Zobov NF, Lisak D, Tennyson J, Polyansky OL.
Balashov AA, et al. Among authors: kyuberis aa.
J Chem Phys. 2023 Jun 21;158(23):234306. doi: 10.1063/5.0152996.
J Chem Phys. 2023.
PMID: 37341294
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Saddle point localization of molecular wavefunctions.
Mellau GCh, Kyuberis AA, Polyansky OL, Zobov N, Field RW.
Mellau GCh, et al. Among authors: kyuberis aa.
Sci Rep. 2016 Sep 15;6:33068. doi: 10.1038/srep33068.
Sci Rep. 2016.
PMID: 27629262
Free PMC article.
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