Search Results - "Tyuterev, V. G."

Murnaghan’s equation of state for the electronic ground state energy by Tyuterev, V.G., Vast, Nathalie

“…In this work, we study the formulae of Murnaghan’s equation of state, reported in the literature and used to fit the theoretical electronic ground state energy…”
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Hole-Phonon Relaxation and Photocatalytic Properties of Titanium Dioxide and Zinc Oxide: First-Principles Approach by Echenique, P. M., Chulkov, E. V., Tyuterev, V. G., Zhukov, V. P.

“…First-principles calculations for the temporal characteristicsof hole-phonon relaxation in the valence band of titanium dioxideand zinc oxide have been…”
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Ozone spectroscopy in the terahertz range from first high-resolution Synchrotron SOLEIL experiments combined with far-infrared measurements and ab initio intensity calculations by Tyuterev, V.G., Barbe, A., Manceron, L., Grouiez, B., Tashkun, S.A., Burgalat, J., Rotger, M.

“…[Display omitted] •New ozone transitions of the rotational and hot ν2-ν2 band observed in the range 0.9–6 THz.•13,466 line positions in FIR / MW ozone spectra…”
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Experiment on Recording Ozone Absorption Transitions to 3A2 Triplet Electronic State by High-Sensitivity Cavity Ring-Down Spectroscopy in the Range 9350–10 000 cm−1 by Vasilchenko, S. S., Egorov, O. V., Tyuterev, V. G.

“…The results of the highly sensitive recording of the absorption spectrum for the Wulf band series in the near-infrared range 9350–10 000 cm –1 , corresponding…”
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Virtual atomic and molecular data centre by Dubernet, M.L., Boudon, V., Culhane, J.L., Dimitrijevic, M.S., Fazliev, A.Z., Joblin, C., Kupka, F., Leto, G., Le Sidaner, P., Loboda, P.A., Mason, H.E., Mason, N.J., Mendoza, C., Mulas, G., Millar, T.J., Nuñez, L.A., Perevalov, V.I., Piskunov, N., Ralchenko, Y., Rixon, G., Rothman, L.S., Roueff, E., Ryabchikova, T.A., Ryabtsev, A., Sahal-Bréchot, S., Schmitt, B., Schlemmer, S., Tennyson, J., Tyuterev, V.G., Walton, N.A., Wakelam, V., Zeippen, C.J.

“…The Virtual Atomic and Molecular Data Centre (VAMDC, http://www.vamdc.eu) is a European Union funded collaboration between groups involved in the generation,…”
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Electron-phonon relaxation and excited electron distribution in zinc oxide and anatase by Zhukov, V P, Tyuterev, V G, Chulkov, E V

“…We propose a first-principles method for evaluations of the time-dependent electron distribution function of excited electrons in the conduction band of…”
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Ab initio study of electron–phonon coupling and excitonic linewidth in GaAs under pressure and in GaP by Sjakste, J., Vast, N., Tyuterev, V.G.

“…Interactions between excited electrons and short-wavelength (intervalley) phonons are the major source for the broadening of the excitonic line in GaAs under…”
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The HITRAN2020 molecular spectroscopic database by Gordon, I.E., Rothman, L.S., Hargreaves, R.J., Hashemi, R., Karlovets, E.V., Skinner, F.M., Conway, E.K., Hill, C., Kochanov, R.V., Tan, Y., Wcisło, P., Finenko, A.A., Nelson, K., Bernath, P.F., Birk, M., Boudon, V., Campargue, A., Chance, K.V., Coustenis, A., Drouin, B.J., Flaud, J.–M., Gamache, R.R., Hodges, J.T., Jacquemart, D., Mlawer, E.J., Nikitin, A.V., Perevalov, V.I., Rotger, M., Tennyson, J., Toon, G.C., Tran, H., Tyuterev, V.G., Adkins, E.M., Baker, A., Barbe, A., Canè, E., Császár, A.G., Dudaryonok, A., Egorov, O., Fleisher, A.J., Fleurbaey, H., Foltynowicz, A., Furtenbacher, T., Harrison, J.J., Hartmann, J.–M., Horneman, V.–M., Huang, X., Karman, T., Karns, J., Kassi, S., Kleiner, I., Kofman, V., Kwabia–Tchana, F., Lavrentieva, N.N., Lee, T.J., Long, D.A., Lukashevskaya, A.A., Lyulin, O.M., Makhnev, V.Yu, Matt, W., Massie, S.T., Melosso, M., Mikhailenko, S.N., Mondelain, D., Müller, H.S.P., Naumenko, O.V., Perrin, A., Polyansky, O.L., Raddaoui, E., Raston, P.L., Reed, Z.D., Rey, M., Richard, C., Tóbiás, R., Sadiek, I., Schwenke, D.W., Starikova, E., Sung, K., Tamassia, F., Tashkun, S.A., Vander Auwera, J., Vasilenko, I.A., Vigasin, A.A., Villanueva, G.L., Vispoel, B., Wagner, G., Yachmenev, A., Yurchenko, S.N.

“…•The HITRAN2020 molecular spectroscopic database and its validations are presented.•Extended line-by-line coverage to 55 molecules, with new isotopologues…”
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The HITRAN2016 molecular spectroscopic database by Gordon, I.E., Rothman, L.S., Hill, C., Kochanov, R.V., Tan, Y., Bernath, P.F., Birk, M., Boudon, V., Campargue, A., Chance, K.V., Drouin, B.J., Flaud, J.-M., Gamache, R.R., Hodges, J.T., Jacquemart, D., Perevalov, V.I., Perrin, A., Shine, K.P., Smith, M.-A.H., Tennyson, J., Toon, G.C., Tran, H., Tyuterev, V.G., Barbe, A., Császár, A.G., Devi, V.M., Furtenbacher, T., Harrison, J.J., Hartmann, J.-M., Jolly, A., Johnson, T.J., Karman, T., Kleiner, I., Kyuberis, A.A., Loos, J., Lyulin, O.M., Massie, S.T., Mikhailenko, S.N., Moazzen-Ahmadi, N., Müller, H.S.P., Naumenko, O.V., Nikitin, A.V., Polyansky, O.L., Rey, M., Rotger, M., Sharpe, S.W., Sung, K., Starikova, E., Tashkun, S.A., Auwera, J. Vander, Wagner, G., Wilzewski, J., Wcisło, P., Yu, S., Zak, E.J.

“…•HITRAN2016 molecular spectroscopic database is described.•Dynamic web interface at www.hitran.org is introduced.•HITRAN Application Programming Interface is…”
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Interaction of Electrons with Polar Optical Phonons in Semiconductor Superlattices by Tyuterev, V. G.

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Ab initio effective rotational Hamiltonians: A comparative study by Cassam-Chenaï, P., Bouret, Y., Rey, M., Tashkun, S. A., Nikitin, A. V., Tyuterev, VL. G.

“…Two independent methods to obtain ab initio effective rotational Hamiltonians have been implemented recently. The first one is based on a generalization of…”
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Experimental Study and Simulation of Singlet-Triplet Rovibronic Ozone Bands in the 11 900–12 800 cm−1 Region by Vasilchenko, S. S., Solodov, A. A., Egorov, O. V., Tyuterev, V. G.

“…A compact absorption spectrometer with a narrowband continuous tunable diode laser is created; it provides sensitivity on the order of 1 × 10 −6 cm −1 in terms…”
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Periodic Orbits and Bifurcations of the Vibrational Modes of the Ozone Molecule at High Energies by Egorov, O. V., Mauguiere, F., Tyuterev, VI. G.

“…The study of quantum states near the dissociation threshold is necessary both to understand the formation of molecules and to explore accurately chemical…”
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Analysis of New Measurements of 18O-substituted Isotopic Species 16O16O18O and 16O18O16O of Ozone in the THz and Far-Infrared Ranges by Starikova, E. N., Barbe, A., Manceron, L., Grouiez, B., Burgalat, J., Tyuterev, V. G.

“…High-resolution spectra corresponding to the rotational and the ν 2 –ν 2 bands of the two most abundant isotopic species of ozone with one heavy 18 O oxygen…”
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Effects of size quantization in the spectra and Γ − M transitions in (GaAs)m(AlAs)n(001) superlattices by Grinyaev, S.N., Nikitina, L.N., Tyuterev, V.G.

“…Based on the pseudopotential method and the phenomenological model of coupling forces, electron scattering by short-wavelength phonons in the conduction band…”
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Effects of size quantization in the spectra and Γ − M transitions in (GaAs) (AlAs) (001) superlattices by Grinyaev, S.N., Nikitina, L.N., Tyuterev, V.G.

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Ab initio calculation of electron-phonon scattering time in germanium by Tyuterev, V. G., Obukhov, S. V., Vast, N., Sjakste, J.

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Full-Dimensional Potential Energy and Dipole Moment Surfaces of GeH4 Molecule and Accurate First-Principle Rotationally Resolved Intensity Predictions in the Infrared by Nikitin, A.V, Rey, M, Rodina, A, Krishna, B. M, Tyuterev, Vl. G

“…Nine-dimensional potential energy surface (PES) and dipole moment surface (DMS) of the germane molecule are constructed using extended ab initio CCSD­(T)…”
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Electron-phonon relaxation and excited electron distribution in gallium nitride by Zhukov, V. P, Tyuterev, V. G, Echenique, P. M, Chulkov, E. V

“…We develop a theory of energy relaxation in semiconductors and insulators highly excited by the long-acting external irradiation. We derive the equation for…”
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Electron-phonon relaxation and excited electron distribution in zinc oxide and anatase by Zhukov, V. P, Tyuterev, V. G, Chulkov, E. V

“…We propose a first-principle method for evaluations of the time-dependent electron distribution function of excited electrons in the conduction band of…”
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