Works by Yurchenko, Sergei

Results: 26

The calculated rovibronic spectrum of scandium hydride, ScH.

Published in:

Molecular Physics, 2015, v. 113, n. 13/14, p. 1998, doi. 10.1080/00268976.2015.1029996

By:

Lodi, Lorenzo;
Yurchenko, Sergei N.;
Tennyson, Jonathan

Publication type:

Article

Rotation-vibration motion of pyramidal XY 3 molecules described in the Eckart frame: Theory and application to NH 3.

Published in:

Molecular Physics, 2005, v. 103, n. 2/3, p. 359, doi. 10.1080/002689705412331517255

By:

Yurchenko, Sergei N.;
Carvajal, Miguel;
Jensen, Per;
Lin, Hai;
Zheng, Jingjing;
Thiel, Walter

Publication type:

Article

Symmetry Adaptation of the Rotation-Vibration Theory for Linear Molecules.

Published in:

Symmetry (20738994), 2018, v. 10, n. 5, p. 137, doi. 10.3390/sym10050137

By:

Chubb, Katy L.;
Jensen, Per;
Yurchenko, Sergei N.

Publication type:

Article

The ExoMol project: Software for computing large molecular line lists.

Published in:

International Journal of Quantum Chemistry, 2017, v. 117, n. 2, p. 92, doi. 10.1002/qua.25190

By:

Tennyson, Jonathan;
Yurchenko, Sergei N.

Publication type:

Article

Infrared Spectra of Small Radicals for Exoplanetary Spectroscopy: OH, NH, CN and CH: The State of Current Knowledge.

Published in:

Molecules, 2023, v. 28, n. 8, p. 3362, doi. 10.3390/molecules28083362

By:

Civiš, Svatopluk;
Pastorek, Adam;
Ferus, Martin;
Yurchenko, Sergei N.;
Boudjema, Noor-Ines

Publication type:

Article

A semi-empirical potential energy surface and line list for H216O extending into the near-ultraviolet.

Published in:

Atmospheric Chemistry & Physics, 2020, v. 20, n. 16, p. 10015, doi. 10.5194/acp-20-10015-2020

By:

Conway, Eamon K.;
Gordon, Iouli E.;
Tennyson, Jonathan;
Polyansky, Oleg L.;
Yurchenko, Sergei N.;
Chance, Kelly

Publication type:

Article

Analysis of the TiO isotopologues in stellar optical spectra.

Published in:

Astronomy & Astrophysics / Astronomie et Astrophysique, 2020, v. 642, p. 1, doi. 10.1051/0004-6361/202037863

By:

Pavlenko, Ya. V.;
Yurchenko, Sergei N.;
McKemmish, Laura K.;
Tennyson, Jonathan

Publication type:

Article

A hybrid line list for CH4 and hot methane continuum.

Published in:

Astronomy & Astrophysics / Astronomie et Astrophysique, 2017, v. 605, p. 1, doi. 10.1051/0004-6361/201731026

By:

Yurchenko, Sergei N.;
Amundsen, David S.;
Tennyson, Jonathan;
Waldmann, Ingo P.

Publication type:

Article

ExoMol at 10.

Published in:

Astronomy & Geophysics, 2021, v. 62, n. 6, p. 6.16, doi. 10.1093/astrogeo/atab102

By:

Tennyson, Jonathan;
Yurchenko, Sergei N

Publication type:

Article

Vibrational spectrum of BiH3: Six-dimensional variational calculations on high-level ab initio potential energy surfaces.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2005, v. 114, n. 4/5, p. 333, doi. 10.1007/s00214-005-0687-3

By:

Yurchenko, Sergei N.;
Breidung, Jürgen;
Thiel, Walter

Publication type:

Article

The 626M24 dataset of validated transitions and empirical rovibrational energy levels of 16O12C16O.

Published in:

Scientific Data, 2025, v. 12, n. 1, p. 1, doi. 10.1038/s41597-025-04755-w

By:

Azzam, Ala'a A. A.;
Alatoom, Dunia;
Abou Doud, Bashar M. J.;
Shersheer, Meera Q. A.;
Almasri, Bailasan K. M.;
Bader, Celin N. M.;
Musleh, Baraa O. A. Kh.;
Obaido, Maria Zakaria Jado;
Abu Khudair, Ahmad M. H.;
Al Shatarat, Adam W. M.;
Qattan, Bana I. M.;
Hamamsy, Loay H. M.;
Saafneh, Abdullah O. G.;
ALso'ub, Mohammad N. A.;
Alkhashashneh, Mera M. A.;
Al-Zawahra, Haneen O. M.;
Ibrahim, Mohammad Taha I.;
Tennyson, Jonathan;
Yurchenko, Sergei N.;
Furtenbacher, Tibor

Publication type:

Article

A semi-empirical potential energy surface and line list for H216O extending into the near-ultraviolet.

Published in:

2020

By:

Conway, Eamon K.;
Gordon, Iouli E.;
Tennyson, Jonathan;
Polyansky, Oleg L.;
Yurchenko, Sergei N.;
Chance, Kelly

Publication type:

Abstract

Simulating electric field interactions with polar molecules using spectroscopic databases.

Published in:

Scientific Reports, 2017, p. 45068, doi. 10.1038/srep45068

By:

Owens, Alec;
Zak, Emil J.;
Chubb, Katy L.;
Yurchenko, Sergei N.;
Tennyson, Jonathan;
Yachmenev, Andrey

Publication type:

Article

A hyperfine-resolved spectroscopic model for vanadium monoxide (51V16O).

Published in:

Molecular Physics, 2024, v. 122, n. 7/8, p. 1, doi. 10.1080/00268976.2023.2255299

By:

Bowesman, Charles A.;
Yurchenko, Sergei N.;
Tennyson, Jonathan

Publication type:

Article

The infrared spectrum of PF3 and analysis of rotational energy clustering effect.

Published in:

Molecular Physics, 2020, v. 118, n. 1, p. 1, doi. 10.1080/00268976.2019.1581951

By:

Mant, Barry P.;
Chubb, Katy L.;
Yachmenev, Andrey;
Tennyson, Jonathan;
Yurchenko, Sergei N.

Publication type:

Article

Ab initio calculations to support accurate modelling of the rovibronic spectroscopy calculations of vanadium monoxide (VO).

Published in:

Molecular Physics, 2016, v. 114, n. 21, p. 3232, doi. 10.1080/00268976.2016.1225994

By:

McKemmish, Laura K.;
Yurchenko, Sergei N.;
Tennyson, Jonathan

Publication type:

Article

Artificial Symmetries for Calculating Vibrational Energies of Linear Molecules.

Published in:

Symmetry (20738994), 2021, v. 13, n. 4, p. 548, doi. 10.3390/sym13040548

By:

Mellor, Thomas M.;
Yurchenko, Sergei N.;
Jensen, Per;
Salvi, Pier Remigio;
Gellini, Cristina;
Bodo, Enrico

Publication type:

Article

Transformation Properties under the Operations of the Molecular Symmetry Groups G36 and G36(EM) of Ethane H3CCH3.

Published in:

Symmetry (20738994), 2019, v. 11, n. 7, p. 862, doi. 10.3390/sym11070862

By:

Mellor, Thomas M.;
Yurchenko, Sergei N.;
Mant, Barry P.;
Jensen, Per

Publication type:

Article

Determination of glyphosate in surface water with high organic matter content.

Published in:

Environmental Science & Pollution Research, 2017, v. 24, n. 9, p. 7880, doi. 10.1007/s11356-017-8522-7

By:

Toss, Vahur;
Leito, Ivo;
Yurchenko, Sergei;
Freiberg, Rene;
Kruve, Anneli

Publication type:

Article

The status of spectroscopic data for the exoplanet characterisation missions.

Published in:

Experimental Astronomy, 2015, v. 40, n. 2/3, p. 563, doi. 10.1007/s10686-014-9385-2

By:

Tennyson, Jonathan;
Yurchenko, Sergei

Publication type:

Article

VIB5 database with accurate ab initio quantum chemical molecular potential energy surfaces.

Published in:

Scientific Data, 2022, v. 9, n. 1, p. 1, doi. 10.1038/s41597-022-01185-w

By:

Zhang, Lina;
Zhang, Shuang;
Owens, Alec;
Yurchenko, Sergei N.;
Dral, Pavlo O.

Publication type:

Article

Empirical Line Lists in the ExoMol Database.

Published in:

Atoms (2218-2004), 2020, v. 8, n. 1, p. 7, doi. 10.3390/atoms8010007

By:

Wang, Yixin;
Tennyson, Jonathan;
Yurchenko, Sergei N.

Publication type:

Article

The ExoMol Atlas of Molecular Opacities.

Published in:

Atoms (2218-2004), 2018, v. 6, n. 2, p. 26, doi. 10.3390/atoms6020026

By:

Tennyson, Jonathan;
Yurchenko, Sergei N.

Publication type:

Article

MARVEL Analysis of High‐Resolution Rovibrational Spectra of 16O13C18O.

Published in:

Journal of Computational Chemistry, 2025, v. 46, n. 1, p. 1, doi. 10.1002/jcc.27541

By:

Azzam, Ala'a A. A.;
Tennyson, Jonathan;
Yurchenko, Sergei N.;
Furtenbacher, Tibor;
Császár, Attila G.

Publication type:

Article

MARVEL analysis of high‐resolution rovibrational spectra of 16O12C18O.

Published in:

Journal of Computational Chemistry, 2024, v. 45, n. 30, p. 2558, doi. 10.1002/jcc.27453

By:

Alatoom, Dunia;
Ibrahim, Mohammad Taha I.;
Furtenbacher, Tibor;
Császár, Attila G.;
Alghizzawi, M.;
Yurchenko, Sergei N.;
Azzam, Ala'a A. A.;
Tennyson, Jonathan

Publication type:

Article

MARVEL analysis of high‐resolution rovibrational spectra of 13C16O2.

Published in:

Journal of Computational Chemistry, 2024, v. 45, n. 13, p. 969, doi. 10.1002/jcc.27266

By:

Ibrahim, Mohammad Taha I.;
Alatoom, Dunia;
Furtenbacher, Tibor;
Császár, Attila G.;
Yurchenko, Sergei N.;
Azzam, Ala'a A. A.;
Tennyson, Jonathan

Publication type:

Article

Works by Yurchenko, Sergei

The calculated rovibronic spectrum of scandium hydride, ScH.

Rotation-vibration motion of pyramidal XY 3 molecules described in the Eckart frame: Theory and application to NH 3.

Symmetry Adaptation of the Rotation-Vibration Theory for Linear Molecules.

The ExoMol project: Software for computing large molecular line lists.

Infrared Spectra of Small Radicals for Exoplanetary Spectroscopy: OH, NH, CN and CH: The State of Current Knowledge.

A semi-empirical potential energy surface and line list for H216O extending into the near-ultraviolet.

Analysis of the TiO isotopologues in stellar optical spectra.

A hybrid line list for CH<sub>4</sub> and hot methane continuum.

ExoMol at 10.

Vibrational spectrum of BiH<sub>3</sub>: Six-dimensional variational calculations on high-level ab initio potential energy surfaces.

The 626M24 dataset of validated transitions and empirical rovibrational energy levels of <sup>16</sup>O<sup>12</sup>C<sup>16</sup>O.

A semi-empirical potential energy surface and line list for H<sub>2</sub><sup>16</sup>O extending into the near-ultraviolet.

Simulating electric field interactions with polar molecules using spectroscopic databases.

A hyperfine-resolved spectroscopic model for vanadium monoxide (<sup>51</sup>V<sup>16</sup>O).

The infrared spectrum of PF<sub>3</sub> and analysis of rotational energy clustering effect.

Ab initio calculations to support accurate modelling of the rovibronic spectroscopy calculations of vanadium monoxide (VO).

Artificial Symmetries for Calculating Vibrational Energies of Linear Molecules.

Transformation Properties under the Operations of the Molecular Symmetry Groups G36 and G36(EM) of Ethane H3CCH3.

Determination of glyphosate in surface water with high organic matter content.

The status of spectroscopic data for the exoplanet characterisation missions.

VIB5 database with accurate ab initio quantum chemical molecular potential energy surfaces.

Empirical Line Lists in the ExoMol Database.

The ExoMol Atlas of Molecular Opacities.

MARVEL Analysis of High‐Resolution Rovibrational Spectra of <sup>16</sup>O<sup>13</sup>C<sup>18</sup>O.

MARVEL analysis of high‐resolution rovibrational spectra of <sup>16</sup>O<sup>12</sup>C<sup>18</sup>O.

MARVEL analysis of high‐resolution rovibrational spectra of 13C16O2.