Электронная библиотека (репозиторий) Томского государственного университета

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Add   Rotational excitation of NS+ by H2 revisited: A new global potential energy surface and rate coefficients
Authors: Bop, C. T. | Kalugina, Yulia N. | Lique, François
Source: Journal of chemical physics. 2022. Vol. 156, № 20. P. 204311-1-204311-7
Type: статьи в журналах
Date: 2022
Description: Due to the lack of specific collisional data, the abundance of NS+ in cold dense interstellar clouds was determined using collisional rate coefficients of CS as a substitute. To better understand the ... More
Add   Collisional excitation of NH by H2: Potential energy surface and scattering calculations
Authors: Pirlot, Paul | Kalugina, Yulia N. | Ramachandran, Ragav | Raffy, Guillaume | Dagdigian, Paul J. | Lique, François
Source: Journal of chemical physics. 2021. Vol. 155, № 13. P. 134303-1-134303-9
Type: статьи в журналах
Date: 2021
Add   Lifetimes and wave functions of ozone metastable vibrational states near the dissociation limit in a full-symmetry approach
Authors: Lapierre, David | Kochanov, Roman V. | Kokoouline, Viatcheslav | Tyuterev, Vladimir G. | Alijah, Alexander
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 ... More
Add   The hyperfine excitation of OH radicals by He
Authors: Marinakis, Sarantos | Kalugina, Yulia N. | Lique, Francois
Source: The European physical journal D. 2016. Vol. 70, № 4. P. 97-103
Type: статьи в журналах
Date: 2016
Description: Hyperfine-resolved collisions between OH radicals and He atoms are investigated using quantum scattering calculations and the most recent ab initio potential energy surface, which explicitly takes int ... More
Add   Accurate first-principles spectra predictions for ethylene from full 12D ab initio surfaces
Authors: Delahaye, Thibault | Rey, Michaël | Tyuterev, Vladimir G. | Szalay, P. G. | Nikitin, Andrei V.
Source: The Twenty-fourth Colloquium on High Resolution Molecular Spectroscopy, Dijon, France, August 24–28, 2015. Dijon, 2015. P. 148
Type: статьи в сборниках
Date: 2015
Add   Collisions of hydroxyl radical with helium, argon and xenon
Authors: Marinakis, Sarantos | Kalugina, Yulia N. | Lique, Francois
Source: ISACC 2015 : 7th International symposium "Atomic cluster collisions", 18-21 July : book of abstracts. Madrid, 2015. P. 15
Type: статьи в сборниках
Date: 2015
Add   Highly exited molecular states: challenge for spectroscopy, dynamics and astrophysics
Authors: Tyuterev, Vladimir G. | Delahaye, Thibault | Nikitin, Andrei V. | Tashkun, Sergey A. | Kochanov, Roman V. | Rey, Michaël
Source: The Twenty-fourth Colloquium on High Resolution Molecular Spectroscopy, Dijon, France, August 24–28, 2015. Dijon, 2015. P. 387
Type: статьи в сборниках
Date: 2015
Add   Wave functions and lifetimes of ozone metastable states above the dissociation threshold: impact on the dynamics
Authors: Kokoouline, Viatcheslav | Alijah, Alexander | Tyuterev, Vladimir G. | Kochanov, Roman V. | Blandon, Juan | Lapierre, David
Source: XVIII Simposium and School on High Resolusion Molecular Spectroscopy HighRus-2015, June 30 – July 4, 2015 : Abstracts of Reports. Tomsk, 2015. P. 37
Type: статьи в сборниках
Date: 2015
Add   О моделировании поверхностей потенциальной энергии для молекулярной спектроскопии
Authors: Кочанов, Роман Викторович | Ташкун, Сергей Анатольевич | Тютерев, Владимир Григорьевич
Source: Оптика атмосферы и океана. 2015. Т. 28, № 5. С. 391-407
Type: статьи в журналах
Date: 2015
Add   Near-resonant rotational energy transfer in HCl–H2 inelastic collisions
Authors: Lanza, Mathieu | Wiesenfeld, Laurent | Lique, Francois | Kalugina, Yulia N.
Source: Journal of chemical physics. 2014. Vol. 140, № 6. P. 064316-1-064316-10
Type: статьи в журналах
Date: 2014
Add   New ab initio potential energy surfaces for the ro-vibrational excitation of OH(X2Π) by He
Authors: Kalugina, Yulia N. | Lique, Francois | Marinakis, Sarantos
Source: Physical chemistry chemical physics. 2014. Vol. 16. P. 13500-13507
Type: статьи в журналах
Date: 2014
Add   A new ab initio potential energy surface for the collisional excitation of HCN by para- and ortho-H2
Authors: Kalugina, Yulia N. | Stoecklin, Thierry | Vera, Mario Hernández | Lique, Francois | Denis-Alpizar, Otoniel
Source: Journal of chemical physics. 2013. Vol. 139, № 22. P. 224301-1-224301-8
Type: статьи в журналах
Date: 2013
Description: We present a new four-dimensional potential energy surface for the collisional excitation of HCN
Add   Collisional excitation of CN(X2Σ+) by para- and ortho-H2: Fine-structure resolved transitions
Authors: Kalugina, Yulia N. | Klos, Jacek | Lique, Francois
Source: Journal of chemical physics. 2013. Vol. 139, № 7. P. 074301-1-074301-11
Type: статьи в журналах
Date: 2013
Add   On the accuracy of explicitly correlated methods to generate potential energy surfaces for scattering calculations and clustering: application to the HCl-He complex
Authors: Hammami, Kamel | Jaidane, Nejm Eddine | Lanza, Mathieu | Kalugina, Yulia N. | Lique, Francois | Hochlaf, Majdi | Ajili, Yosra
Source: Physical chemistry chemical physics. 2013. Vol. 15, № 25. P. 10062-10070
Type: статьи в журналах
Date: 2013
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