S Yurchenko's publications

Papers, book chapters etc

Papers

publications
[221] Jonathan Tennyson, Sergei N. Yurchenko, Ahmed F. Al-Refaie, Victoria H.J. Clark, Katy L. Chubb, Eamon K. Conway, Akhil Dewan, Maire N. Gorman, Christian Hill, A.E. Lynas-Gray, Thomas Mellor, Laura K. McKemmish, Alec Owens, Oleg L. Polyansky, Mikhail Semenov, Wilfrid Somogyi, Giovanna Tinetti, Apoorva Upadhyay, Ingo Waldmann, Yixin Wang, Samuel Wright, and Olga P. Yurchenko. The 2020 release of the ExoMol database: molecular line lists for exoplanet and other hot atmospheres. J. Quant. Spectrosc. Radiat. Transf., page 107228, 2020. [ bib | DOI | http | .pdf ]
[220] E. K. Conway, I. E. Gordon, J. Tennyson, O. L. Polyansky, S. N. Yurchenko, and K. Chance. A semi-empirical potential energy surface and line list for H216O extending into the near-ultraviolet. Atmos. Chem. Phys., 20(16):10015--10027, 2020. [ bib | DOI | http | .pdf ]
[219] L. K. McKemmish, A. M. Syme, J. Borsovszky, S. N. Yurchenko, J Tennyson, T. Furtenbacher, and A. G. Császár. Update to the MARVEL dataset and ExoMol line list for 12C2. MNRAS, 497(1):1081--1097, 2020. [ bib | DOI | http | .pdf ]
[218] Siddharth Gandhi, Matteo Brogi, Sergei N Yurchenko, Jonathan Tennyson, Phillip A Coles, Rebecca K Webb, Jayne L Birkby, Gloria Guilluy, George A Hawker, Nikku Madhusudhan, Aldo S Bonomo, and Alessandro Sozzetti. Molecular cross-sections for high-resolution spectroscopy of super-Earths, warm Neptunes, and hot Jupiters. MNRAS, 495(1):224--237, 2020. [ bib | DOI | arXiv | http | .pdf ]
[217] Daniel Darby-Lewis, Jonathan Tennyson, Sergei N Yurchenko, and Kerry Lawson. Vibrationally resolved electron impact electronic excitation of BeH. J. Phys. B: At. Mol. Opt. Phys., 53(13), 2020. [ bib | DOI | http | .pdf ]
[216] Jérémy Bourgalais, Nathalie Carrasco, Quentin Changeat, Olivia Venot, Lora Jovanović, Pascal Pernot, Jonathan Tennyson, Katy L. Chubb, Sergey N. Yurchenko, and Giovanna Tinetti. Ions in the thermosphere of exoplanets: Observable constraints revealed by innovative laboratory experiments. ApJ, 895(2):77, 2020. [ bib | DOI | http | .pdf ]
[215] A Owens, E K Conway, J Tennyson, and S N Yurchenko. ExoMol line lists - XXXVIII. High-temperature molecular line list of silicon dioxide (SiO2). MNRAS, 495(2):1927--1933, 2020. staa1287. [ bib | DOI | arXiv | http | .pdf ]
[214] Yixin Wang, Alec Owens, Jonathan Tennyson, and Sergei N. Yurchenko. MARVEL analysis of the measured high-resolution rovibronic spectra of the calcium monohydroxide radical (CaOH). ApJS, 248(1):9, apr 2020. [ bib | DOI | http | .pdf ]
[213] Alain Campargue, Alexaander M Solodov, Alexander A. Solodov, Andrey Yachmenev, and Sergey N Yurchenko. Detection of electric-quadrupole transitions in water vapour near 5.4 and 2.5 μm. Phys. Chem. Chem. Phys., 22:12476--12481, 2020. [ bib | DOI | http | .pdf ]
[212] Tibor Furtenbacher, Phillip A. Coles, Jonathan Tennyson, Sergei N. Yurchenko, Shanshan Yu, Brian Drouin, Roland Tóbiás, and Attila G. Császár. Empirical rovibrational energy levels of ammonia up to 7500 cm-1. J. Quant. Spectrosc. Radiat. Transf., 251:107027, 2020. [ bib | DOI | http | .pdf ]
[211] Sergei N. Yurchenko, Jonathan Tennyson, Steve Miller, Vladlen V. Melnikov, James O'Donoghue, and Luke Moore. ExoMol line lists -- XL. Ro-vibrational molecular line list for Hydronium ion (H3O+). MNRAS, 497(2):2340--2351, 07 2020. [ bib | DOI | http ]
[210] S. N. Yurchenko, Thomas M. Mellor, Richard S. Freedman, and J. Tennyson. ExoMol line lists -- XXXIX. Ro-vibrational molecular line list for CO2. MNRAS, 496(4):5282--5291, 2020. [ bib | DOI | http | .pdf ]
[209] S. N. Yurchenko and Thomas M. Mellor. Treating linear molecule XY2 in calculations of rotation-vibration spectra. J. Chem. Phys., page submitted, 2020. [ bib ]
[208] Daniel Darby-Lewis, Jonathan Tennyson, Sergei N Yurchenko, and Kerry Lawson. Vibrationally resolved electron impact electronic excitation of BeH. J. Phys. B: At. Mol. Opt. Phys., 2020. [ bib | DOI | .pdf ]
[207] Alain Campargue, Samir Kassi, Andrey Yachmenev, Aleksandra A. Kyuberis, Jochen Küpper, and Sergei N. Yurchenko. Observation of electric-quadrupole infrared transitions in water vapor. Phys. Rev. Research, 2:023091, Apr 2020. [ bib | DOI | http | .pdf ]
[206] Rebecca K Webb, Matteo Brogi, Siddharth Gandhi, Michael R Line, Jayne L Birkby, Katy L Chubb, Ignas A G Snellen, and Sergey N Yurchenko. A weak spectral signature of water vapour in the atmosphere of HD 179949 b at high spectral resolution in the L-band. MNRAS, 494(1):108--119, 2020. [ bib | DOI | http | .pdf ]
[205] Victoria H.J. Clark, Alec Owens, Jonathan Tennyson, and Sergei N. Yurchenko. The high-temperature rotation-vibration spectrum and rotational clustering of silylene (SiH2). J. Quant. Spectrosc. Radiat. Transf., 246:106929, 2020. [ bib | DOI | http | .pdf ]
[204] Katy L Chubb, Jonathan Tennyson, and Sergey N Yurchenko. ExoMol molecular line lists - XXXVII: spectra of acetylene. Monthly Notices of the Royal Astronomical Society, 493(2):1531--1545, 2020. [ bib | DOI | arXiv | http | .pdf ]
[203] Yixin Wang, Jonathan Tennyson, and Sergei N. Yurchenko. Empirical Line Lists in the ExoMol Database. Atoms, 8(1), 2020. [ bib | DOI | http | .pdf ]
[202] G. Peach, S. Yurchenko, K. Chubb, I. Baraffe, M. Phillips, and P. Tremblin. The resonance lines of sodium and potassium in brown dwarf spectra. Contributions of the Astronomical Observatory Skalnaté Pleso, 50(1):193--202, 2020. [ bib | DOI | http | .pdf ]
[201] Pavlenko, Yakiv V., Yurchenko, Sergei N., and Tennyson, Jonathan. Analysis of the first overtone bands of isotopologues of CO and SiO in stellar spectra. A&A, 633:A52, 2020. [ bib | DOI | http | .pdf ]
[200] Phillip A Coles, Sergei N Yurchenko, and Jonathan Tennyson. ExoMol molecular line lists XXXV: a rotation-vibration line list for hot ammonia. MNRAS, 490(4):4638--4647, 2019. stz2778. [ bib | DOI | arXiv | http | .pdf ]
[199] P. B. Rimmer, M. Ferus, I. P. Waldmann, A. Knížek, D. Kalvaitis, O. Ivanek, P. Kubelík, S. N. Yurchenko, T. Burian, J. Dostál, L. Juha, R. Dudžák, M. Kru}s, J. Tennyson, S. Civiš, A. T. Archibald, and A. Granville-Willett. Identifiable Acetylene Features Predicted for Young Earth-like Exoplanets with Reducing Atmospheres Undergoing Heavy Bombardment. ApJ, 888(1):21, dec 2019. [ bib | DOI | http | .pdf ]
[198] Alexander N. Smirnov, Victor G. Solomonik, Sergei N. Yurchenko, and Jonathan Tennyson. Spectroscopy of YO from first principles. Phys. Chem. Chem. Phys., 21:22794--22810, 2019. [ bib | DOI | http | .pdf ]
[197] Angelos Tsiaras, Ingo P Waldmann, Giovanna Tinetti, Jonathan Tennyson, and Sergey N Yurchenko. Water vapour in the atmosphere of the habitable-zone eight-Earth-mass planet K2-18 b. Nature Astronomy, 3:1086--1091, 2019. [ bib | DOI | .pdf ]
[196] Maire N Gorman, Sergei N Yurchenko, and Jonathan Tennyson. ExoMol molecular line lists XXXVI: X2Π-X2Π and A2Σ-X2Π transitions of SH. MNRAS, 490:1652--1665, 2019. [ bib | DOI | http | .pdf ]
[195] Alec Owens and Sergei N. Yurchenko. Theoretical rotation-vibration spectroscopy of cis- and trans-diphosphene (P2H2) and the deuterated species P2HD. J. Chem. Phys., 150(19):194308, 2019. [ bib | DOI | arXiv | www: | .pdf ]
[194] Ahmad Y. Adam, Per Jensen, Andrey Yachmenev, and Sergei N. Yurchenko. Nonresonant Raman spectra of the methyl radical 12CH3 simulated in variational calculations. J. Mol. Spectrosc., 362:77 -- 83, 2019. [ bib | DOI | http | .pdf ]
[193] Ahmad Y. Adam, Andrey Yachmenev, Sergei N. Yurchenko, and Per Jensen. Variationally Computed IR Line List for the Methyl Radical CH3. J. Phys. Chem. A, 123(22):4755--4763, 2019. [ bib | DOI | http | .pdf ]
[192] Robert J. Hargreaves, Iouli E. Gordon, Laurence S. Rothman, Sergey A. Tashkun, Valery I. Perevalov, Anastasiya A. Lukashevskaya, Sergey N. Yurchenko, Jonathan Tennyson, and Holger S.P. Müller. Spectroscopic line parameters of NO, NO2, and N2O for the HITEMP database. J. Quant. Spectrosc. Radiat. Transf., 232:35--53, 2019. [ bib | DOI | http | .pdf ]
[191] Jonathan Langleben, Jonathan Tennyson, Sergei N Yurchenko, and Peter Bernath. ExoMol line list - XXXIV. A rovibrational line list for phosphinidene (PH) in its X 3Σ- and a 1Δ electronic states. MNRAS, 488(2):2332--2342, 07 2019. [ bib | DOI | arXiv | http | .pdf ]
[190] Barry P. Mant, Katy L. Chubb, Andrey Yachmenev, Jonathan Tennyson, and Sergei N. Yurchenko. The infrared spectrum of PF3 and analysis of rotational energy clustering effect. Mol. Phys., 118(1):e1581951, 2019. [ bib | DOI | arXiv | http | .pdf ]
[189] Heng Ying Li, Sergei N Yurchenko, and Jonathan Tennyson. ExoMol line lists - XXXII. The rovibronic spectrum of MgO. Monthly Notices of the Royal Astronomical Society, 486(2):2351--2365, 04 2019. [ bib | DOI | arXiv | http | .pdf ]
[188] Phillip A. Coles, Sergei N. Yurchenko, Richard P. Kovacich, James Hobby, and Jonathan Tennyson. A variationally computed room temperature line list for AsH3. Phys. Chem. Chem. Phys., 21:3264--3277, 2019. [ bib | DOI | http | .pdf ]
[187] Laura K McKemmish, Thomas Masseron, H Jens Hoeijmakers, Víctor Pérez-Mesa, Simon L Grimm, Sergei N Yurchenko, and Jonathan Tennyson. ExoMol molecular line lists - XXXIII. The spectrum of Titanium Oxide. MNRAS, 488(2):2836--2854, 07 2019. [ bib | DOI | arXiv | http | .pdf ]
[186] Thomas M. Mellor, Sergei N. Yurchenko, Barry P. Mant, and Per Jensen. Transformation Properties under the Operations of the Molecular Symmetry Groups G36 and G36(EM) of Ethane H3CCH3. Symmetry, 11(7), 2019. [ bib | DOI | http | .pdf ]
[185] Jonathan Tennyson and Sergei Yurchenko. The ExoMol Atlas of Molecular Opacities. Atoms, 6:26, May 2018. [ bib | DOI | .pdf ]
[184] Sergei N. Yurchenko, Ahmed F. Al-Refaie, and Jonathan Tennyson. ExoCross: a general program for generating spectra from molecular line lists. A&A, 614:A131, Jun 2018. [ bib | DOI | .pdf ]
[183] A. Tsiaras, I. P. Waldmann, T. Zingales, M. Rocchetto, G. Morello, M. Damiano, K. Karpouzas, G. Tinetti, L. K. McKemmish, J. Tennyson, and S. N. Yurchenko. A Population Study of Gaseous Exoplanets. ApJ, 155:156, Apr 2018. [ bib | DOI | .pdf ]
[182] Katy L. Chubb, Andrey Yachmenev, Jonathan Tennyson, and Sergei N. Yurchenko. Treating linear molecule HCCH in calculations of rotation-vibration spectra. J. Chem. Phys., 149:014101, Jul 2018. [ bib | DOI | .pdf ]
[181] D. Darby-Lewis, J. Tennyson, K. D. Lawson, S. N. Yurchenko, M. F. Stamp, A. Shaw, S. Brezinsek, and JET Contributors. Synthetic spectra of BeH, BeD and BeT for emission modeling in jet plasmas. J. Phys. B: At. Mol. Opt. Phys., 51(18), SEP 28 2018. [ bib | DOI | .pdf ]
[180] K. L Chubb, M. Joseph, J. Franklin, N. Choudhury, T. Furtenbacher, A. G. Császár, G. Gaspard, P. Oguoko, A. Kelly, S. N. Yurchenko, J. Tennyson, and C. Sousa-Silva. MARVEL analysis of the measured high-resolution spectra of acetylene. J. Quant. Spectrosc. Radiat. Transf., 204:42--55, 2018. [ bib | DOI | .pdf ]
[179] Katy L. Chubb, Olga Naumenko, Stefan Keely, Sebestiano Bartolotto, Skye Macdonald, Mahmoud Mukhtar, Andrey Grachov, Joe White, Eden Coleman, Anwen Liu, Alexander Z. Fazliev, Elena R. Polovtseva, Veli-Matti Horneman, Alain Campargue, Tibor Furtenbacher, Attila G. Császár, Sergei N. Yurchenko, and Jonathan Tennyson. MARVEL analysis of the measured high-resolution rovibrational spectra of H232S . J. Quant. Spectrosc. Radiat. Transf., 218:178 -- 186, 2018. [ bib | DOI | http | .pdf ]
[178] P. A. Coles, R. I. Ovsyannikov, O. L. Polyansky, S. N. Yurchenko, and J. Tennyson. Improved potential energy surface and spectral assignments for ammonia in the near-infrared region. J. Quant. Spectrosc. Radiat. Transf., 219:199--212, 2018. [ bib | DOI | .pdf ]
[177] L. Rutkowski, A. Foltynowicz, A. C. Johansson, A. Khodabakhsh, F. M. Schmidt, A. A. Kyuberis, N. F. Zobov, S. N. Yurchenko O. L. Polyansky, and J. Tennyson. An experimental water line list at 1950 K in the 6250 -- 6670 cm-1 region. J. Quant. Spectrosc. Radiat. Transf., 205:213--219, 2018. [ bib | DOI | .pdf ]
[176] Nikolai F. Zobov, Phillip A. Coles, Roman I. Ovsyannikov, Aleksandra A. Kyuberis, Robert J. Hargreaves, Peter F. Bernath, Jonathan Tennyson, Sergei N. Yurchenko, and Oleg L. Polyansky. Analysis of the red and green optical absorption spectrum of gas phase ammonia. J. Quant. Spectrosc. Radiat. Transf., 209:224--231, 2018. [ bib | DOI | http | .pdf ]
[175] Barry P. Mant, Andrey Yachmenev, Jonathan Tennyson, and Sergei N. Yurchenko. ExoMol molecular line lists - XXVII. Spectra of C2H4. MNRAS, 478:3220--3232, Aug 2018. [ bib | DOI | .pdf ]
[174] A. Owens, A. Yachmenev, W. Thiel, A. Fateev, J. Tennyson, and S. N. Yurchenko. ExoMol line lists - XXIX. The rotation-vibration spectrum of methyl chloride up to 1200 K. MNRAS, 479(3):3002--3010, SEP 2018. [ bib | DOI | .pdf ]
[173] A. Owens, S. N. Yurchenko, and V. Špirko. Anomalous phosphine sensitivity coefficients as probes for a possible variation of the proton-to-electron mass ratio. MNRAS, 473:4986--4992, Feb 2018. [ bib | DOI | .pdf ]
[172] Oleg L. Polyansky, Aleksandra A. Kyuberis, Nikolai F. Zobov, Jonathan Tennyson, Sergei N. Yurchenko, and Lorenzo Lodi. ExoMol molecular line lists XXX: A complete high-accuracy line list for water. MNRAS, 480:2597--2608, 2018. [ bib | DOI | .pdf ]
[171] Apoorva Upadhyay, Eamon K. Conway, Jonathan Tennyson, and Sergei N. Yurchenko. ExoMol line lists XXV: A hot line list for silicon sulphide, SiS. MNRAS, 477:1520--1527, Jun 2018. [ bib | DOI | .pdf ]
[170] Sergei N. Yurchenko, Wesley Bond, Maire N. Gorman, Lorenzo Lodi, Laura K. McKemmish, William Nunn, Rohan Shah, and Jonathan Tennyson. ExoMol molecular line lists - XXVI: Spectra of SH and NS. MNRAS, 478:270--282, Jul 2018. [ bib | DOI | .pdf ]
[169] S. N. Yurchenko, Frances Sinden, Lorenzo Lodi, Christian Hill, Maire N. Gorman, and J. Tennyson. ExoMol Molecular linelists -- XXIV: A new hot line list for silicon monohydride, SiH. MNRAS, 473:5324--5333, 2018. [ bib | DOI | .pdf ]
[168] S. N. Yurchenko, Istvan Szabo, Elizaveta Pyatenko, and J. Tennyson. ExoMol Molecular line lists XXXI: The spectrum of C2. MNRAS, 480:3397--3411, 2018. [ bib | DOI | .pdf ]
[167] Sergei N. Yurchenko, Henry Williams, Paul C. Leyland, Lorenzo Lodi, and Jonathan Tennyson. ExoMol linelists XXVIII: The rovibronic spectrum of AlH. MNRAS, 479:1401--1411, Sep 2018. [ bib | DOI | .pdf ]
[166] Alec Owens, Andrey Yachmenev, Jochen Küpper, Sergei N Yurchenko, and Walter Thiel. The rotation--vibration spectrum of methyl fluoride from first principles. Phys. Chem. Chem. Phys., 21:3496--3505, 2018. [ bib | DOI | http | .pdf ]
[165] Alec Owens, Andrey Yachmenev, Sergei N. Yurchenko, and Jochen Küpper. Climbing the rotational ladder to chirality. Phys. Rev. Lett., 121:193201, Nov 2018. [ bib | DOI | http | .pdf ]
[164] Giovanna Tinetti, Pierre Drossart, Paul Eccleston, Paul Hartogh, Astrid Heske, Jérémy Leconte, Giusi Micela, Marc Ollivier, Göran Pilbratt, Ludovic Puig, Diego Turrini, Bart Vandenbussche, Paulina Wolkenberg, Jean-Philippe Beaulieu, Lars A. Buchave, Martin Ferus, Matt Griffin, Manuel Guedel, Kay Justtanont, Pierre-Olivier Lagage, Pedro Machado, Giuseppe Malaguti, Michiel Min, Hans Ulrik Nørgaard-Nielsen, Mirek Rataj, Tom Ray, Ignasi Ribas, Mark Swain, Robert Szabo, Stephanie Werner, Joanna Barstow, Matt Burleigh, James Cho, Vincent Coudé du Foresto, Athena Coustenis, Leen Decin, Therese Encrenaz, Marina Galand, Michael Gillon, Ravit Helled, Juan Carlos Morales, Antonio García Muñoz, Andrea Moneti, Isabella Pagano, Enzo Pascale, Giuseppe Piccioni, David Pinfield, Subhajit Sarkar, Franck Selsis, Jonathan Tennyson, Amaury Triaud, Olivia Venot, Ingo Waldmann, David Waltham, Gillian Wright, Jerome Amiaux, Jean-Louis Auguères, Michel Berthé, Naidu Bezawada, Georgia Bishop, Neil Bowles, Deirdre Coffey, Josep Colomé, Martin Crook, Pierre-Elie Crouzet, Vania Da Peppo, Isabel Escudero Sanz, Mauro Focardi, Martin Frericks, Tom Hunt, Ralf Kohley, Kevin Middleton, Gianluca Morgante, Roland Ottensamer, Emanuele Pace, Chris Pearson, Richard Stamper, Kate Symonds, Miriam Rengel, Etienne Renotte, Peter Ade, Laura Affer, Christophe Alard, Nicole Allard, Francesca Altieri, Yves André, Claudio Arena, Ioannis Argyriou, Alan Aylward, Cristian Baccani, Gaspar Bakos, Marek Banaszkiewicz, Mike Barlow, Virginie Batista, Giancarlo Bellucci, Serena Benatti, Pernelle Bernardi, Bruno Bézard, Maria Blecka, Emeline Bolmont, Bertrand Bonfond, Rosaria Bonito, Aldo S. Bonomo, John Robert Brucato, Allan Sacha Brun, Ian Bryson, Waldemar Bujwan, Sarah Casewell, Bejamin Charnay, Cesare Cecchi Pestellini, Guo Chen, Angela Ciaravella, Riccardo Claudi, Rodolphe Clédassou, Mario Damasso, Mario Damiano, Camilla Danielski, Pieter Deroo, Anna Maria Di Giorgio, Carsten Dominik, Vanessa Doublier, Simon Doyle, René Doyon, Benjamin Drummond, Bastien Duong, Stephen Eales, Billy Edwards, Maria Farina, Ettore Flaccomio, Leigh Fletcher, François Forget, Steve Fossey, Markus Fränz, Yuka Fujii, Álvaro García-Piquer, Walter Gear, Hervé Geoffray, Jean Claude Gérard, Lluis Gesa, H. Gomez, Rafal Graczyk, Caitlin Griffith, Denis Grodent, Mario Giuseppe Guarcello, Jacques Gustin, Keiko Hamano, Peter Hargrave, Yann Hello, Kevin Heng, Enrique Herrero, Allan Hornstrup, Benoit Hubert, Shigeru Ida, Masahiro Ikoma, Nicolas Iro, Patrick Irwin, Christopher Jarchow, Jean Jaubert, Hugh Jones, Queyrel Julien, Shingo Kameda, Franz Kerschbaum, Pierre Kervella, Tommi Koskinen, Matthijs Krijger, Norbert Krupp, Marina Lafarga, Federico Landini, Emanuel Lellouch, Giuseppe Leto, A. Luntzer, Theresa Rank-Lüftinger, Antonio Maggio, Jesus Maldonado, Jean-Pierre Maillard, Urs Mall, Jean-Baptiste Marquette, Stephane Mathis, Pierre Maxted, Taro Matsuo, Alexander Medvedev, Yamila Miguel, Vincent Minier, Giuseppe Morello, Alessandro Mura, Norio Narita, Valerio Nascimbeni, N. Nguyen Tong, Vladimiro Noce, Fabrizio Oliva, Enric Palle, Paul Palmer, Maurizio Pancrazzi, Andreas Papageorgiou, Vivien Parmentier, Manuel Perger, Antonino Petralia, Stefano Pezzuto, Ray Pierrehumbert, Ignazio Pillitteri, Giampaolo Piotto, Giampaolo Pisano, Loredana Prisinzano, Aikaterini Radioti, Jean-Michel Réess, Ladislav Rezac, Marco Rocchetto, Albert Rosich, Nicoletta Sanna, Alexandre Santerne, Giorgio Savini, Gaetano Scandariato, Bruno Sicardy, Carles Sierra, Giuseppe Sindoni, Konrad Skup, Ignas Snellen, Mateusz Sobiecki, Lauriane Soret, Alessandro Sozzetti, A. Stiepen, Antoine Strugarek, Jake Taylor, William Taylor, Luca Terenzi, Marcell Tessenyi, Angelos Tsiaras, C. Tucker, Diana Valencia, Gautam Vasisht, Allona Vazan, Francesc Vilardell, Sabrine Vinatier, Serena Viti, Rens Waters, Piotr Wawer, Anna Wawrzaszek, Anthony Whitworth, Yuk L. Yung, Sergey N. Yurchenko, María Rosa Zapatero Osorio, Robert Zellem, Tiziano Zingales, and Frans Zwart. A chemical survey of exoplanets with ARIEL. Experimental Astronomy, Sep 2018. [ bib | DOI | http | .pdf ]
[163] Patrick G. J. Irwin, Neil Bowles, Ashwin S. Braude, Ryan Garland, Simon Calcutt, Phillip A. Coles, Sergei N. Yurchenko, and Jonathan Tennyson. Analysis of gaseous ammonia (NH3) absorption in the visible spectrum of Jupiter - Update. Icarus, 321:572--582, 2018. [ bib | DOI | .pdf ]
[162] Katy L. Chubb, Per Jensen, and Sergei N. Yurchenko. Symmetry adaptation of the rotation-vibration theory for linear molecules. Symmetry, 10(5), MAY 2018. [ bib | DOI | .pdf ]
[161] Pavlo O. Dral, Alec Owens, Sergei N. Yurchenko, and Walter Thiel. Structure-based sampling and self-correcting machine learning for accurate calculations of potential energy surfaces and vibrational levels. J. Chem. Phys., 146:244108, June 2017. [ bib | DOI | .pdf ]
[160] S. N. Yurchenko, D. S. Amundsen, J. Tennyson, and I P Waldmann. A hybrid line list for CH4 and hot methane continuum. A&A, 605:A95, 2017. [ bib | DOI | http | .pdf ]
[159] Ahmed F. Al-Refaie, Sergei N. Yurchenko, and Jonathan Tennyson. GPU Accelerated INtensities MPI GAIN-MPI: A new method of computing Einstein-A coefficients. Comput. Phys. Commun., 214:216--224, 2017. [ bib | DOI | .pdf ]
[158] Jonathan Tennyson and Sergei N. Yurchenko. The ExoMol project: Software for computing large molecular line lists. Intern. J. Quantum Chem., 117(2):92--103, JAN 2017. [ bib | DOI | .pdf ]
[157] Sergei N. Yurchenko, Andrey Yachmenev, and Roman I. Ovsyannikov. Symmetry adapted ro-vibrational basis functions for variational nuclear motion: TROVE approach. J. Chem. Theory Comput., 13(9):4368--4381, 2017. [ bib | DOI | arXiv | http | .pdf ]
[156] Emma J. Barton, Sergei N. Yurchenko, Jonathan Tennyson, Sonnik Clausen, and Alexander Fateev. High-resolution absorption measurements of NH3 at high temperatures: 2100-5500 cm-1. J. Mol. Spectrosc., 189:60--65, MAR 2017. [ bib | DOI | .pdf ]
[155] Emma J. Barton, C. Hill, M. Czurylo, H. Y. Li, A. Hyslop, Sergei N. Yurchenko, and Jonathan Tennyson. The ExoMol pressure broadening diet: H2 and He line-broadening parameters. J. Quant. Spectrosc. Radiat. Transf., 203:490--495, Dec 2017. [ bib | DOI | .pdf ]
[154] Emma J. Barton, C. Hill, Sergei N. Yurchenko, Jonathan Tennyson, Anna S. Dudaryonok, and Nina N. Layrentieva. Pressure-dependent water absorption cross sections for exoplanets and other atmospheres. J. Quant. Spectrosc. Radiat. Transf., 187:453--460, JAN 2017. [ bib | DOI | .pdf ]
[153] Emma J. Barton, Oleg L. Polyansky, Sergei. N. Yurchenko, Jonathan Tennyson, S. Civiš, M. Ferus, R. Hargreaves, R. I. Ovsyannikov, A. A. Kyuberis, N. F. Zobov, S. Béguier, and A. Campargue. Absorption spectra of ammonia near 1 μm. J. Quant. Spectrosc. Radiat. Transf., 203:392--397, 2017. [ bib | DOI | .pdf ]
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[124] Laura K. McKemmish, Sergei N. Yurchenko, and Jonathan Tennyson. Ab initio calculations to support accurate modelling of the rovibronic spectroscopy calculations of vanadium monoxide (VO). Mol. Phys., 114(21):3232--3248, 2016. [ bib | DOI | .pdf ]
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[92] Daniel S. Underwood, Sergei N. Yurchenko, Jonathan Tennyson, and Per Jensen. Rotational spectrum of SO3 and theoretical evidence for the formation of sixfold rotational energy-level clusters in its vibrational ground state. J. Chem. Phys., 140(24), JUN 28 2014. [ bib | DOI | .pdf ]
[91] Clara Sousa-Silva, Nicholas Hesketh, Sergei N. Yurchenko, Christian Hill, and Jonathan Tennyson. High temperature partition functions and thermodynamic data for ammonia and phosphine. J. Quant. Spectrosc. Radiat. Transf., 142:66--74, JUL 2014. [ bib | DOI | .pdf ]
[90] R. J. Barber, J. K. Strange, C. Hill, O. L. Polyansky, G. Ch. Mellau, S. N. Yurchenko, and Jonathan Tennyson. ExoMol line lists - III. An improved hot rotation-vibration line list for HCN and HNC. MNRAS, 437(2):1828--1835, JAN 2014. [ bib | DOI | .pdf ]
[89] Emma J. Barton, Christopher Chiu, Shirin Golpayegani, Sergei N. Yurchenko, Jonathan Tennyson, Daniel J. Frohman, and Peter F. Bernath. ExoMol molecular line lists V: The ro-vibrational spectra of NaCl and KCl. MNRAS, 442(2):1821--1829, AUG 1 2014. [ bib | DOI | .pdf ]
[88] Sergei N. Yurchenko and Jonathan Tennyson. ExoMol line lists - IV. The rotation-vibration spectrum of methane up to 1500 K. MNRAS, 440(2):1649--1661, MAY 2014. [ bib | DOI | .pdf ]
[87] Jonathan Tennyson and SergeiN. Yurchenko. The status of spectroscopic data for the exoplanet characterisation missions. Exp. Astron., pages 1--13, 2014. [ bib | DOI | http | .pdf ]
[86] Leo Yorke, Sergei N. Yurchenko, Lorenzo Lodi, and Jonathan Tennyson. Exomol molecular line lists - VI. A high temperature line list for phosphorus nitride. MNRAS, 445(2):1383--1391, DEC 1 2014. [ bib | DOI | .pdf ]
[85] Sergei N. Yurchenko, Jonathan Tennyson, Jeremy Bailey, Morgan D. J. Hollis, and Giovanna Tinetti. Spectrum of hot methane in astronomical objects using a comprehensive computed line list. Proc. Natl. Acad. Sci. U. S. A., 111(26):9379--9383, JUL 1 2014. [ bib | DOI | .pdf ]
[84] V. V. Melnikov and S. N. Yurchenko. Rotational states of the hydrogen molecule in the crystalline silicon matrix. Russ. Phys. J., 56(12):1363--1369, APR 2014. [ bib | DOI | .pdf ]
[83] Sergei N. Yurchenko. Chapter 7: Electric dipole moments of small polyatomic molecules from first principles. In Chemical Modelling: Volume 10, volume 10, pages 183--228. The Royal Society of Chemistry, 2014. [ bib | DOI | http ]
[82] I. P. Waldmann, G. Tinetti, P. Deroo, M. D. J. Hollis, S. N. Yurchenko, and J. Tennyson. Blind extraction of an exoplanetary spectrum through independent component analysis. ApJ, 766(1), MAR 20 2013. [ bib | DOI | .pdf ]
[81] Clara Sousa-Silva, Sergei N. Yurchenko, and Jonathan Tennyson. A computed room temperature line list for phosphine. J. Mol. Spectrosc., 288:28--37, JUN 2013. [ bib | DOI | .pdf ]
[80] Sergei N. Yurchenko, Jonathan Tennyson, Robert J. Barber, and Walter Thiel. Vibrational transition moments of CH4 from first principles. J. Mol. Spectrosc., 291(SI):69--76, SEP 2013. [ bib | DOI | .pdf ]
[79] Roberto Marquardt, Kenneth Sagui, Jingjing Zheng, Walter Thiel, David Luckhaus, Sergey Yurchenko, Fabio Mariotti, and Martin Quack. Global analytical potential energy surface for the electronic ground state of NH3 from high level ab initio calculations. J. Phys. Chem. A, 117(32):7502--7522, AUG 15 2013. [ bib | DOI | .pdf ]
[78] Oleg L. Polyansky, Igor N. Kozin, Roman I. Ovsyannikov, Pawel Malyszek, Jacek Koput, Jonathan Tennyson, and Sergei N. Yurchenko. Variational calculation of highly excited rovibrational energy levels of H2O2. J. Phys. Chem. A, 117(32):7367--7377, AUG 15 2013. [ bib | DOI | .pdf ]
[77] Ala'a A. A. Azzam, Sergei N. Yurchenko, Jonathan Tennyson, Marie-Aline Martin-Drumel, and Olivier Pirali. Terahertz spectroscopy of hydrogen sulfide. J. Quant. Spectrosc. Radiat. Transf., 130(SI):341--351, NOV 2013. [ bib | DOI | .pdf ]
[76] Michael J. Down, Christian Hill, Sergei N. Yurchenko, Jonathan Tennyson, Linda R. Brown, and Isabelle Kleiner. Re-analysis of ammonia spectra: Updating the HITRAN 14NH3 database. J. Quant. Spectrosc. Radiat. Transf., 130(SI):260--272, NOV 2013. [ bib | DOI | .pdf ]
[75] Emma J. Barton, Sergei N. Yurchenko, and Jonathan Tennyson. ExoMol line lists - II. The ro-vibrational spectrum of SiO. MNRAS, 434(2):1469--1475, SEP 2013. [ bib | DOI | .pdf ]
[74] Daniel S. Underwood, Jonathan Tennyson, and Sergei N. Yurchenko. An ab initio variationally computed room-temperature line list for 32S16O3. Phys. Chem. Chem. Phys., 15(25):10118--10125, 2013. [ bib | DOI | .pdf ]
[73] Christian Hill, Sergei N. Yurchenko, and Jonathan Tennyson. Temperature-dependent molecular absorption cross sections for exoplanets and other atmospheres. Icarus, 226(2):1673--1677, 2013. [ bib | DOI | .pdf ]
[72] Mark Swain, Pieter Deroo, Giovanna Tinetti, Morgan Hollis, Marcell Tessenyi, Michael Line, Hajime Kawahara, Yuka Fujii, Adam P. Showman, and Sergey N. Yurchenko. Probing the extreme planetary atmosphere of WASP-12b. Icarus, 225(1):432--445, JUL 2013. [ bib | DOI | .pdf ]
[71] Jonathan Tennyson, Christian Hill, and Sergei N. Yurchenko. Data structures for ExoMol: Molecular line lists for exoplanet and other atmospheres. In JD Gillaspy, WL Wiese, and YA Podpaly, editors, Eighth International Conference on Atomic and Molecular Data and Their Applications: ICAMDATA-8, volume 1545 of AIP Conference Proceedings, pages 186--195. 2013. [ bib | DOI | .pdf ]
[70] S. N. Yurchenko and J. Tennyson. ExoMol: Molecular line lists for exoplanet and other atmospheres. In C Stehle, C Joblin, and L DHendecourt, editors, European Conference on Laboratory Astrophysics -- ECLA, volume 58 of Euro. Astron. Soc. Publications Series, pages 243--248, 2013. [ bib | DOI | .pdf ]
[69] A. Martinez-Mesa, L. Zhechkov, S. N. Yurchenko, T. Heine, G. Seifert, and J. Rubayo-Soneira. Hydrogen physisorption on carbon foams upon inclusion of many-body and quantum delocalization effects. J. Phys. Chem. C, 116:19543--19553, 2012. [ bib | DOI | .pdf ]
[68] Jonathan Tennyson and Sergei N. Yurchenko. ExoMol: Molecular line lists for exoplanet and other atmospheres. MNRAS, 425:21--33, 2012. [ bib | DOI | .pdf ]
[67] Benjamin Yadin, Thomas Veness, Pierandrea Conti, Christian Hill, Sergei N. Yurchenko, and Jonathan Tennyson. ExoMol line lists - I. The rovibrational spectrum of BeH, MgH and CaH in the X2 Σ+ state. MNRAS, 425:34--43, 2012. [ bib | DOI | .pdf ]
[66] G. Tinetti, J. P. Beaulieu, T. Henning, M. Meyer, G. Micela, I. Ribas, D. Stam, M. Swain, O. Krause, M. Ollivier, E. Pace, B. Swinyard, A. Aylward, R. van Boekel, A. Coradini, T. Encrenaz, I. Snellen, M. R. Zapatero-Osorio, J. Bouwman, J. Y-K. Cho, V. Coude du Foresto, T. Guillot, M. Lopez-Morales, I. Mueller-Wodarg, E. Palle, F. Selsis, A. Sozzetti, P. A. R. Ade, N. Achilleos, A. Adriani, C. B. Agnor, C. Afonso, C. Allende Prieto, G. Bakos, R. J. Barber, M. Barlow, V. Batista, P. Bernath, B. Bezard, P. Borde, L. R. Brown, A. Cassan, C. Cavarroc, A. Ciaravella, C. Cockell, A. Coustenis, C. Danielski, L. Decin, R. De Kok, O. Demangeon, P. Deroo, P. Doel, P. Drossart, L. N. Fletcher, M. Focardi, F. Forget, S. Fossey, P. Fouque, J. Frith, M. Galand, P. Gaulme, J. I. Gonzalez Hernandez, O. Grasset, D. Grassi, J. L. Grenfell, M. J. Griffin, C. A. Griffith, U. Groezinger, M. Guedel, P. Guio, O. Hainaut, R. Hargreaves, P. H. Hauschildt, K. Heng, D. Heyrovsky, R. Hueso, P. Irwin, L. Kaltenegger, P. Kervella, D. Kipping, T. T. Koskinen, G. Kovacs, A. La Barbera, H. Lammer, E. Lellouch, G. Leto, M. A. Lopez Valverde, M. Lopez-Puertas, C. Lovis, A. Maggio, J. P. Maillard, J. Maldonado Prado, J. B. Marquette, F. J. Martin-Torres, P. Maxted, S. Miller, S. Molinari, D. Montes, A. Moro-Martin, J. I. Moses, O. Mousis, N. Nguyen Tuong, R. Nelson, G. S. Orton, E. Pantin, E. Pascale, S. Pezzuto, D. Pinfield, E. Poretti, R. Prinja, L. Prisinzano, J. M. Rees, A. Reiners, B. Samuel, A. Sanchez-Lavega, J. Sanz Forcada, D. Sasselov, G. Savini, B. Sicardy, A. Smith, L. Stixrude, G. Strazzulla, J. Tennyson, M. Tessenyi, G. Vasisht, S. Vinatier, S. Viti, I. Waldmann, G. J. White, T. Widemann, R. Wordsworth, R. Yelle, Y. Yung, and S. N. Yurchenko. EChO. Exp. Astron., 34:311--353, 2012. [ bib | DOI | .pdf ]
[65] Oleg L. Polyansky, Nikolay F. Zobov, Irina I. Mizus, Lorenzo Lodi, Sergei N. Yurchenko, Jonathan Tennyson, Attila G. Császár, and Oleg V. Boyarkin. Global spectroscopy of the water monomer. Philos. Trans. R. Soc. A-Math. Phys. Eng. Sci., 370:2728--2748, 2012. [ bib | DOI | .pdf ]
[64] Sergei N. Yurchenko, Bassem Assfour, Eduard V. Lavrov, and Gotthard Seifert. Combined IR absorption and modeling study of nanoporous zeolite imidazolate frameworks (ZIFs) filled with hydrogen. RSC Adv., 2:9839--9845, 2012. [ bib | DOI | .pdf ]
[63] B. Swinyard, G. Tinetti, P. Eccleston, and 24 others. An integrated payload design for the exoplanet characterisation observatory (EChO). SPIE, 8442:8442G, 2012. [ bib | DOI | .pdf ]
[62] J. P. Beaulieu, G. Tinetti, D. M. Kipping, I. Ribas, R. J. Barber, J. Y. K. Cho, I. Polichtchouk, J. Tennyson, S. N. Yurchenko, C. A. Griffith, V. Batista, I. Waldmann, S. Miller, S. Carey, O. Mousis, S. J. Fossey, and A. Aylward. Methane in the atmosphere of the transiting hot neptune GJ 436B? ApJ, 731:16, 2011. [ bib | DOI | .pdf ]
[61] A. Martinez-Mesa, S. N. Yurchenko, S. Patchkovskii, T. Heine, and G. Seifert. Influence of quantum effects on the physisorption of molecular hydrogen in model carbon foams. J. Chem. Phys., 135:214701, 2011. [ bib | DOI | .pdf ]
[60] Andrey Yachmenev, Sergei N. Yurchenko, Per Jensen, and Walter Thiel. A new “spectroscopic” potential energy surface for formaldehyde in its ground electronic state. J. Chem. Phys., 134:244307, 2011. [ bib | DOI | .pdf ]
[59] Andrey Yachmenev, Sergei N. Yurchenko, Tristan Ribeyre, and Walter Thiel. High-level ab initio potential energy surfaces and vibrational energies of H2CS. J. Chem. Phys., 135:074302, 2011. [ bib | DOI | .pdf ]
[58] Sergei N. Yurchenko, Robert J. Barber, Jonathan Tennyson, Walter Thiel, and Per Jensen. Towards efficient refinement of molecular potential energy surfaces: Ammonia as a case study. J. Mol. Spectrosc., 268:123--129, 2011. [ bib | DOI | .pdf ]
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[56] S. N. Yurchenko, R. J. Barber, and J. Tennyson. A variationally computed line list for hot NH3. MNRAS, 413:1828--1834, 2011. [ bib | DOI | .pdf ]
[55] Giovanna Tinetti, James Y-K. Cho, Caitlin A. Griffith, Olivier Grasset, Lee Grenfell, Tristan Guillot, Tommi T. Koskinen, Julianne I. Moses, David Pinfield, Jonathan Tennyson, Marcell Tessenyi, Robin Wordsworth, Alan Aylward, Roy van Boekel, Angioletta Coradini, Therese Encrenaz, Ignas Snellen, Maria R. Zapatero-Osorio, Jeroen Bouwman, Vincent Conde du Foresto, Mercedes Lopez-Morales, Ingo Mueller-Wodarg, Enric Palle, Franck Selsis, Alessandro Sozzetti, Jean-Philippe Beaulieu, Thomas Henning, Michael Meyer, Giuseppina Micela, Ignasi Ribas, Daphne Stam, Mark Swain, Oliver Krause, Marc Ollivier, Emanuele Pace, Bruce Swinyard, Peter A. R. Ade, Nick Achilleos, Alberto Adriani, Craig B. Agnor, Cristina Afonso, Carlos Allende Prieto, Gaspar Bakos, Robert J. Barber, Michael Barlow, Peter Bernath, Bruno Bezard, Pascal Borde, Linda R. Brown, Arnaud Cassan, Celine Cavarroc, Angela Ciaravella, Charles Cockell, Athena Coustenis, Camilla Danielski, Lean Decin, Remco De Kok, Olivier Demangeon, Pieter Deroo, Peter Doel, Pierre Drossart, Leigh N. Fletcher, Matteo Focardi, Francois Forget, Steve Fossey, Pascal Fouque, James Frith, Marina Galand, Patrick Gaulme, Jonay I. Gonzalez Hernandez, Davide Grassi, Matt J. Griffin, Ulrich Groezinger, Manuel Guedel, Pactrick Guio, Olivier Hainaut, Robert Hargreaves, Peter H. Hauschildt, Kevin Heng, David Heyrovsky, Ricardo Hueso, Pat Irwin, Lisa Kaltenegger, Patrick Kervella, David Kipping, Geza Kovacs, Antonin La Barbera, Helmut Lammar, Emmanuel Lellouch, Giuseppe Leto, Mercedes Lopez Morales, Miguel A. Lopez Valverde, Manuel Lopez-Puertas, Christophe Lovis, Antonio Maggio, Jean-Pierre Maillard, Jesus Maldonado Prado, Jean-Baptiste Marquette, Francisco J. Martin-Torres, Pierre Maxted, Steve Miller, Sergio Molinari, David Montes, Amaya Moro-Martin, Olivier Mousis, Napoleon Nguyen Tuong, Richard Nelson, Glenn S. Orton, Eric Pantin, Enzo Pascale, Stefano Pezzuto, Ennio Poretti, Raman Prinja, Loredana Prisinzano, Jean-Michel Reess, Ansgar Reiners, Benjamin Samuel, Jorge Sanz Forcada, Dimitar Sasselov, Giorgio Savini, Bruno Sicardy, Alan Smith, Lars Stixrude, Giovanni Strazzulla, Gautam Vasisht, Sandrine Vinatier, Serena Viti, Ingo Waldmann, Glenn J. White, Thomas Widemann, Roger Yelle, Yuk Yung, and Sergey Yurchenko. The science of EChO. In A Sozzetti, MG Lattanzi, and AP Boss, editors, Astrophysics of Planetary Systems: Formation, Structure, and Dynamical Evolution, volume 276 of IAU Symposium Proceedings Series, pages 359--370, 2011. 276th Symposium of the International-Astronomical-Union on Astrophysics of Planetary Systems: Formation, Structure, and Dynamical Evolution, Torino, ITALY, OCT 10-15, 2010. [ bib | DOI | .pdf ]
[54] Bassem Assfour, Stefano Leoni, Sergei Yurchenko, and Gotthard Seifert. Hydrogen storage in zeolite imidazolate frameworks. a multiscale theoretical investigation. Int. J. Hydrog. Energy, 36:6005--6013, 2011. [ bib | DOI | .pdf ]
[53] I. I. Bubukina, N. F. Zobov, O. L. Polyansky, S. V. Shirin, and S. N. Yurchenko. Optimized semiempirical potential energy surface for H216O up to 26000 cm-1. Opt. Spectrosc., 110:160--166, 2011. [ bib | DOI | .pdf ]
[52] P. W. Lucas, C. G. Tinney, Ben Burningham, S. K. Leggett, David J. Pinfield, Richard Smart, Hugh R. A. Jones, Federico Marocco, Robert J. Barber, Sergei N. Yurchenko, Jonathan Tennyson, Miki Ishii, Motohide Tamura, Avril C. Day-Jones, Andrew Adamson, France Allard, and Derek Homeier. A very cool, very nearby brown dwarf hiding in the galactic plane. In CMJ JohnsKrull, MK Browning, and AA West, editors, 16 TH Cambridge Workshop on Cool Stars, Stellar Systems and the Sun, volume 448 of Astronomical Society of the Pacific Conference Series, pages 339--346, 2011. 16th Cambridge Workshop on Cool Stars, Stellar Systems and the Sun, Univ Washington, Seattle, WA, AUG 28-SEP 03, 2010. [ bib ]
[51] Andrey Yachmenev, Sergei N. Yurchenko, Ivana Paidarova, Per Jensen, Walter Thiel, and Stephan P. A. Sauer. Thermal averaging of the indirect nuclear spin-spin coupling constants of ammonia: The importance of the large amplitude inversion mode. J. Chem. Phys., 132:114305, 2010. [ bib | DOI | .pdf ]
[50] Sergei N. Yurchenko, Miguel Carvajal, Andrey Yachmenev, Walter Thiel, and Per Jensen. A theoretical-spectroscopy, ab initio-based study of the electronic ground state of 121SbH3. J. Quant. Spectrosc. Radiat. Transf., 111:2279--2290, 2010. [ bib | DOI | .pdf ]
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[48] B. A. Voronin, J. Tennyson, R. N. Tolchenov, A. A. Lugovskoy, and S. N. Yurchenko. A high accuracy computed line list for the HDO molecule. MNRAS, 402:492--496, 2010. [ bib | DOI | .pdf ]
[47] Andrey Yachmenev, Sergei N. Yurchenko, Per Jensen, Oliver Baum, Thomas F. Giesen, and Walter Thiel. Theoretical rotation-torsion spectra of HSOH. Phys. Chem. Chem. Phys., 12:8387--8397, 2010. [ bib | DOI | .pdf ]
[46] Sergei N. Yurchenko, Roman I. Ovsyannikov, Walter Thiel, and Per Jensen. Rotation-vibration energy cluster formation in XH2D and XHD2 molecules (X = Bi, P, and Sb). J. Mol. Spectrosc., 256:119--127, 2009. [ bib | DOI | .pdf ]
[45] Sergei N. Yurchenko, Andrey Yachmenev, Walter Thiel, Oliver Baum, Thomas F. Giesen, Vladlen V. Melnikov, and Per Jensen. An ab initio calculation of the vibrational energies and transition moments of HSOH. J. Mol. Spectrosc., 257:57--65, 2009. [ bib | DOI | .pdf ]
[44] Sergei N. Yurchenko, Robert J. Barber, Andrey Yachmenev, Walter Thiel, Per Jensen, and Jonathan Tennyson. A variationally computed T=300 K line list for NH3. J. Phys. Chem. A, 113:11845--11855, 2009. [ bib | DOI | .pdf ]
[43] R. I. Ovsyannikov, P. Jensen, M. Yu. Tretyakov, and S. N. Yurchenko. On the use of the finite difference method in a calculation of vibration-rotation energies. Opt. Spectrosc., 107:221--227, 2009. [ bib | DOI | .pdf ]
[42] Sergei N. Yurchenko, Walter Thiel, Miguel Carvajal, and Per Jensen. Ab initio potential energy surface, electric-dipole moment, polarizability tensor, and theoretical rovibrational spectra in the electronic ground state of 14NH3+. Chem. Phys., 346:146--159, 2008. [ bib | DOI | .pdf ]
[41] Oliver Baum, Monika Koerber, Oliver Ricken, Gisbert Winnewisser, Sergei N. Yurchenko, Stephan Schlemmer, Koichi M. T. Yamada, and Thomas F. Giesen. The rotational spectrum of H32SOH and H34SOH above 1 THz. J. Chem. Phys., 129:224312, 2008. [ bib | DOI | .pdf ]
[40] Roman I. Ovsyannikov, Vladlen V. Melnikov, Walter Thiel, Per Jensen, Oliver Baum, Thomas F. Giesen, and Sergei N. Yurchenko. Theoretical rotation-torsion energies of HSOH. J. Chem. Phys., 129:154314, 2008. [ bib | DOI | .pdf ]
[39] Roman I. Ovsyannikov, Walter Thiel, Sergei N. Yurchenko, Miguel Carvajal, and Per Jensen. Vibrational energies of PH3 calculated variationally at the complete basis set limit. J. Chem. Phys., 129:044309, 2008. [ bib | DOI | .pdf ]
[38] S. N. Yurchenko, B. A. Voronin, R. N. Tolchenov, N. Doss, O. V. Naumenko, W. Thiel, and Jonathan Tennyson. Potential energy surface of HDO up to 25 000 cm-1. J. Chem. Phys., 128:044312, 2008. [ bib | DOI | .pdf ]
[37] Roman I. Ovsyannikov, Walter Thiel, Sergei N. Yurchenko, Miguel Carvajal, and Per Jensen. PH3 revisited: Theoretical transition moments for the vibrational transitions below 7000 cm-1. J. Mol. Spectrosc., 252:121--128, 2008. [ bib | DOI | .pdf ]
[36] Sergei N. Yurchenko, Walter Thiel, and Per Jensen. Theoretical ROVibrational energies (TROVE): A robust numerical approach to the calculation of rovibrational energies for polyatomic molecules. J. Mol. Spectrosc., 245:126--140, 2007. [ bib | DOI | .pdf ]
[35] P. R. Bunker, W. P. Kraemer, S. N. Yurchenko, W. Thiel, C. F. Neese, J. L. Gottfried, and Per Jensen. New potential energy surfaces for the X and A states of CH2+. Mol. Phys., 105:1369--1376, 2007. [ bib | DOI | .pdf ]
[34] Z. J. Jakubek, P. R. Bunker, M. Zachwieja, S. G. Nakhate, B. Simard, S. N. Yurchenko, W. Thiel, and P. Jensen. A dispersed fluorescence and ab initio investigation of the X2 B1 and A2 A1 electronic states of the PH2 molecule. J. Chem. Phys., 124:094306, 2006. [ bib | DOI | .pdf ]
[33] Sergei N. Yurchenko, Miguel Carvajal, Walter Thiel, and Per Jensen. Ab initio dipole moment and theoretical rovibrational intensities in the electronic ground state of PH3. J. Mol. Spectrosc., 239:71--87, 2006. [ bib | DOI | .pdf ]
[32] Sergel N. Yurchenko, Walter Thiel, and Per Jensen. Rotational energy cluster formation in XY3 molecules: Excited vibrational states of BiH3 and SbH3. J. Mol. Spectrosc., 240:174--187, 2006. [ bib | DOI | .pdf ]
[31] S. N. Yurchenko, W. Thiel, Per Jensen, and P. R. Bunker. Rotation-vibration energy level clustering in the X2 B1 ground electronic state of PH2. J. Mol. Spectrosc., 239:160--173, 2006. [ bib | DOI | .pdf ]
[30] P. R. Bunker, R. Guerout, Z. J. Jakubek, Per Jensen, and S. N. Yurchenko. The rovibronic energies of the SiNSi radical in its X2 Πg electronic state. J. Molec. Struct. (THEOCHEM), 795:9--13, 2006. [ bib | DOI | .pdf ]
[29] Sergei N. Yurchenko, Jingjing Zheng, Walter Thiel, Miguel Carvajal, Hai Lin, and Per Jensen. Theoretical quantitative spectroscopy: Computer simulation of molecular spectra. In A Perrin, NB SariZizi, and J Demaison, editors, Remote Sensing of the Atmosphere for Envrionmental Security, Nato Science for Peace and Security Series C - Environmental Security, pages 171--183, 2006. NATO Advanced Research Workshop on Remote Sensing of the Atmosphere for Environmental Security, Rabat, Morocco, Nov 16-19, 2005. [ bib | DOI | .pdf ]
[28] S. N. Yurchenko, M. Carvajal, H. Lin, J. J. Zheng, W. Thiel, and P. Jensen. Dipole moment and rovibrational intensities in the electronic ground state of NH3: Bridging the gap between ab initio theory and spectroscopic experiment. J. Chem. Phys., 122:104317, 2005. [ bib | DOI | .pdf ]
[27] S. N. Yurchenko, J. G. Zheng, H. Lin, P. Jensen, and W. Thiel. Potential-energy surface for the electronic ground state of NH3 up to 20,000 cm-1 above equilibrium. J. Chem. Phys., 123:134308, 2005. [ bib | DOI | .pdf ]
[26] S. N. Yurchenko, M. Carvajalz, P. Jensen, H. Lin, J. J. Zheng, and W. Thiel. Rotation-vibration motion of pyramidal XY3 molecules described in the Eckart frame: Theory and application to NH3. Mol. Phys., 103:359--378, 2005. [ bib | DOI | .pdf ]
[25] S. N. Yurchenko, W. Thiel, S. Patchkovskii, and P. Jensen. Theoretical evidence for the formation of rotational energy level clusters in the vibrational ground state of PH3. Phys. Chem. Chem. Phys., 7:573--582, 2005. [ bib | DOI | .pdf ]
[24] S. N. Yurchenko, P. R. Bunker, and P. Jensen. Coulomb explosion imaging: the CH3+ and H3O+ molecules. J. Molec. Struct. (THEOCHEM), 742:43--48, 2005. [ bib | DOI | .pdf ]
[23] S. N. Yurchenko, W. Thiel, M. Carvajal, H. Lin, and P. Jensen. Rotation-vibration motion of pyramidal XY3 molecules described in the Eckart frame: The calculation of intensities with application to NH3. Adv. Quant. Chem., 48:209--238, 2005. [ bib | DOI | .pdf ]
[22] S. Patchkovskii, J. S. Tse, S. N. Yurchenko, L. Zhechkov, T. Heine, and G. Seifert. Graphene nanostructures as tunable storage media for molecular hydrogen. Proc. Natl. Acad. Sci. U. S. A., 102:10439--10444, 2005. [ bib | DOI | .pdf ]
[21] S. N. Yurchenko, J. Breidung, and W. Thiel. Vibrational spectrum of BiH3: Six-dimensional variational calculations on high-level ab initio potential energy surfaces. Theor. Chem. Acc., 114:333--340, 2005. [ bib | DOI | .pdf ]
[20] S. N. Yurchenko, P. R. Bunker, W. P. Kraemer, and P. Jensen. The spectrum of singlet SiH2. Can. J. Chem., 82:694--708, 2004. [ bib | DOI | .pdf ]
[19] S. Patchkovskii and S. N. Yurchenko. Quantum and classical equilibrium properties for exactly solvable models of weakly interacting systems. Phys. Chem. Chem. Phys., 6:4152--4155, 2004. [ bib | DOI | .pdf ]
[18] S. N. Yurchenko, S. Patchkovskii, I. V. Litvinyuk, P. B. Corkum, and G. L. Yudin. Laser-induced interference, focusing, and diffraction of rescattering molecular photoelectrons. Phys. Rev. Lett., 93:223003, 2004. [ bib | DOI | .pdf ]
[17] P. R. Bunker, B. Ostojic, and S. Yurchenko. A theoretical study of the millimeterwave spectrum of CH5+. J. Molec. Struct. (THEOCHEM), 695:253--261, 2004. [ bib | DOI | .pdf ]
[16] S. N. Yurchenko, M. Carvajal, P. Jensen, F. Herregodts, and T. R. Huet. Potential parameters of PH3 obtained by simultaneous fitting of ab initio data and experimental vibrational band origins. Chem. Phys., 290:59--67, 2003. [ bib | DOI | .pdf ]
[15] H. Lin, W. Thiel, S. N. Yurchenko, M. Carvajal, and P. Jensen. Vibrational energies for NH3 based on high level ab initio potential energy surfaces. J. Chem. Phys., 117:11265--11276, 2002. [ bib | DOI | .pdf ]
[14] S. N. Yurchenko, P. Jensen, Y. Li, R. J. Buenker, and P. R. Bunker. The near ultraviolet band system of singlet methylene. J. Mol. Spectrosc., 208:136--143, 2001. [ bib | DOI | .pdf ]
[13] G. A. Onopenko, E. A. Sinitsyn, S. N. Yurchenko, V. V. Melnikov, E. S. Bekhtereva, and O. N. Ulenikov. On isotopic effect in xh2 (c2v) molecules with arbitrary value of equilibrium angle: Xh2 -> xhd. Atmos. Ocean. Opt., 14:120--122, 2001. [ bib ]
[12] G. A. Onopenko, E. A. Sinitsyn, S. N. Yurchenko, V. V. Melnikov, E. S. Bekhtereva, and O. N. Ulenikov. Some manifestations of the effect of isotopic substitution in axially symmetric XH3 (C3 v) molecules: XH3 - XH2D. Atmos. Ocean. Opt., 14:195--197, 2001. [ bib ]
[11] O. N. Ulenikov and S. N. Yurchenko. Sextic centrifugal distortion constants in the local mode approach. Atmos. Ocean. Opt., 12:125--129, 1999. [ bib ]
[10] O. N. Ulenikov and S. N. Yurchenko. On second-order anharmonic constants for XY2 molecules in the local-mode approach. Russ. Phys. J., 42:457--461, 1999. [ bib | DOI | .pdf ]
[9] H. Lin, O. N. Ulenikov, S. Yurchinko, X. G. Wang, and Q. S. Zhu. High-resolution spectroscopic study of the (310) local mode combination band system of AsH3. J. Mol. Spectrosc., 187:89--96, 1998. [ bib | DOI | .pdf ]
[8] O. N. Ulenikov and S. N. Yurchenko. Method for determination of fundamental characteristics of diatomic molecules from their vibrational-rotational spectra. Atmos. Ocean. Opt., 11:296--300, 1998. [ bib ]
[7] J. X. Han, O. N. Ulenikov, S. Yurchinko, L. Y. Hao, X. G. Wang, and Q. S. Zhu. High resolution photoacoustic spectrum of AsH3 (600a1/e) bands. Spectra Chimica Acta A, 53:1705--1712, 1997. [ bib | DOI | .pdf ]
[6] O. N. Ulenikov, S. N. Yurchenko, and R. N. Tolchenov. On the study of XY2(my mx) plane molecules. Spectra Chimica Acta A, 53:329--334, 1997. [ bib | DOI | .pdf ]
[5] S. N. Yurchenko. Recurrence algorithm for calculation of the rotational and centrifugal constants of diatomic-molecules. Opt. Spektrosk., 78:907--910, 1995. [ bib | .pdf ]
[4] I. R. Sorokin and S. N. Yurchenko. Iterative procedure for determining high-order corrections to the vibration-rotation spectra of diatomic molecules. Russ. Phys. J., 37:522--528, 1994. [ bib | DOI | .pdf ]
[3] S. N. Yurchenko. Numerical test for correctness in applying an iterative procedure to calculations in direct spectroscopic problems involving diatomic molecules. Russ. Phys. J., 37:1148--1152, 1994. [ bib | DOI | .pdf ]
[2] A. V. Shapovalov and S. N. Yurchenko. Using the complex WKB method for studying the evolution of initial pulses obeying the nonlinear Schrödinger equation . Russ. Phys. J., 36:431--437, 1993. [ bib | DOI | .pdf ]
[1] A. V. Shapovalov and S. N. Yurchenko. Effect of initial pulse shape modulation on spontaneous soliton formation in the nse model. Russ. Phys. J., 35:508--513, 1992. [ bib | DOI | .pdf ]

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