A comparative analysis of simulation of collision induced dissociation on two different potential energy surfaces
- Авторлар: Azriel V.M.1, Akimov V.M.1, Ermolova E.V.1, Kabanov D.B.1, Kolesnikova L.I.1, Rusin L.Y.1, Sevryuk M.B.1
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Мекемелер:
- Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
- Шығарылым: Том 43, № 12 (2024)
- Беттер: 16-29
- Бөлім: Элементарные физико-химические процессы
- URL: https://vestnikugrasu.org/0207-401X/article/view/684174
- DOI: https://doi.org/10.31857/S0207401X24120024
- ID: 684174
Дәйексөз келтіру
Аннотация
We present the results of quasiclassical trajectory simulation of dissociation of CsBr molecules in collisions with Xe atoms (at collision energies ranging from 3 to 12 eV) on two diabatic potential energy surfaces differing in the parameters of the potential well and of the repulsive wall for the pairwise interaction potential between the xenon atom and the bromide anion. The dynamical characteristics of both the dissociation channels (of the formation of the atomic ions and of that of the ion complex XeCs+) are practically independent of the interaction potential between Xe and Br–.
Авторлар туралы
V. Azriel
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
V. Akimov
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
E. Ermolova
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
D. Kabanov
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
L. Kolesnikova
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
L. Rusin
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Хат алмасуға жауапты Автор.
Email: rusin@chph.ras.ru
Ресей, Moscow
M. Sevryuk
Semenov Federal Research Center for Chemical Physics, Russian Academy of Sciences
Email: rusin@chph.ras.ru
Ресей, Moscow
Әдебиет тізімі
- Encyclopedia of Low Temperature Plasma, Introductory Vol. I (Sections I–III), Ed. by V. E. Fortov (Nauka, Moscow, 2000) [in Russian].
- B.A. Knyazev. Low Temperature Plasma and Gas Discharge (Novosib. Gos. Univ., Novosibirsk, 2003) [in Russian].
- L.Yu. Rusin, M.B. Sevryuk, V.M. Akimov, and D.B. Kabanov. TsITiS Report No. AAAA-B16-216100670036-8 (Tal’rose Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2016).
- P. Bayat, D. Gatineau, D. Lesage, A. Martinez, and R.B. Cole. J. Mass Spectrometry 57, e4879 (2022). https://doi.org/10.1002/jms.4879
- G. Yassaghi, Z. Kukačka, J. Fiala et al. Anal. Chem. 94, 9993 (2022). https://doi.org/10.1021/acs.analchem.1c05476
- F. Xu, W. Wang, L. Ding, X. Fang, and Ch.-F. Ding. Anal. Chem. 94, 17827 (2022). https://doi.org/10.1021/acs.analchem.2c03524
- J. Cho, Yu. Tao, Yu. Georgievskii et al., Proc. Combustion Inst. 39, 601 (2023). https://doi.org/10.1016/j.proci.2022.07.155
- K. Parker, N.E. Bollis, and V. Ryzhov. Mass Spectrometry Rev. 43, 47 (2024). https://doi.org/10.1002/mas.21819
- V.V. Shumova, D.N. Polyakov, and L.M. Vasilyak, Russ. J. Phys. Chem. B 16, 912 (2022). https://doi.org/10.1134/S1990793122050232
- Y. Chengxun, L. Zhijian, V.L. Bychkov, D.V. Bychkov, M.G. Golubkov, T.A. Maslov, I.D. Rodionov, I.P. Rodionova, I.G. Stepanov, S.Ya. Umanskii, and G.V. Golubkov. Russ. J. Phys. Chem. B 16, 955 (2022). https://doi.org/10.1134/S1990793122050189
- S.N. Kozlov and B.E. Zhestkov. Russ. J. Phys. Chem. B 16, 1030 (2022). https://doi.org/10.1134/S1990793122060069
- V.M. Azriel’, V.M. Akimov, E.V. Ermolova, D.B. Kabanov, L.I. Kolesnikova, L.Yu. Rusin, and M.B. Sevryuk. Russ. J. Phys. Chem. B 16, 1057 (2022). https://doi.org/10.1134/S1990793122060148
- M. Mirahmadi and J. Pérez-Ríos. Intern. Rev. Phys. Chem. 41, 233 (2023). https://doi.org/10.1080/0144235X.2023.2237300
- V.V. Shumova, D.N. Polyakov, and L.M. Vasilyak. Russ. J. Phys. Chem. B 17, 986 (2023). https://doi.org/10.1134/S1990793123040280
- V.M. Azriel’, V.M. Akimov, E.V. Ermolova, D.B. Kabanov, L.I. Kolesnikova, L.Yu. Rusin, and M.B. Sevryuk. Russ. J. Phys. Chem. B 17, 1270 (2023). https://doi.org/10.1134/S1990793123060155
- J.J. Ewing, R. Milstein, and R. S. Berry. J. Chem. Phys. 54, 1752 (1971). https://doi.org/10.1063/1.1675082
- E.K. Parks, M. Inoue, and S. Wexler, J. Chem. Phys. 76, 1357 (1982). https://doi.org/10.1063/1.443129
- E.K. Parks, L.G. Pobo, and S. Wexler. J. Chem. Phys. 80, 5003 (1984). https://doi.org/10.1063/1.446523
- A.S. Davydov. Quantum Mechanics (Pergamon Press, Oxford, 1976).
- A. Messiah. Quantum Mechanics, Vol. 2 (North-Holland, Amsterdam, 1962).
- V.M. Azriel’. Doctoral Dissertation in Physics and Mathematics (Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2008).
- V.M. Akimov, V.M. Azriel’, E.V. Ermolova, et al., Phys. Chem. Chem. Phys. 23, 7783 (2021). https://doi.org/10.1039/d0cp04183a
- S.I. Kabanikhin, J. Inverse Ill-posed Probl. 16, 317 (2008). https://doi.org/10.1515/JIIP.2008.019
- S.I. Kabanikhin. Inverse and Ill-posed Problems: Theory and Applications (De Gruyter, Berlin, 2012). https://doi.org/10.1515/9783110224016
- A.N. Tikhonov and V.Ya. Arsenin. Solutions of Ill-posed Problems (Winston, Washington, D.C. and Wiley, New York, 1977).
- K. Chadan and P. C. Sabatier. Inverse Problems in Quantum Scattering Theory (Springer, New York, 1989). https://doi.org/10.1007/978-3-642-83317-5
- V.M. Akimov, A.A. Zembekov, L.A. Lomakin, et al., Dokl. Akad. Nauk SSSR 253, 633 (1980).
- A.A. Zembekov, A.I. Maergoǐz, E.E. Nikitin, and L.Yu. Rusin, Teoret. Eksper. Khimiya 17, 579 (1981).
- A.I. Maergoǐz, E.E. Nikitin, and L. Yu. Rusin, in Plasma Chemistry, Ed. by B. M. Smirnov (Energoatomizdat, Moscow, 1985), Vol. 12, p. 3 [in Russian].
- V.M. Azriel’, V.M. Akimov, J. Gryko, and L.Yu. Rusin, Sov. J. Chem. Phys. 8, 2205 (1991).
- V.M. Azriel’, V.M. Akimov, J. Gryko, and L.Yu. Rusin, Sov. J. Chem. Phys. 8, 2464 (1991).
- L.Yu. Rusin, J. Chem. Biochem. Kinetics 1, 205 (1991).
- V.M. Azriel’, L.Yu. Rusin, and M.B. Sevryuk, Sov. J. Chem. Phys. 12, 2079 (1994).
- V.M. Azriel’, L.Yu. Rusin, and M.B. Sevryuk. Theor. Chim. Acta 87, 195 (1993). https://doi.org/10.1007/BF01112933
- L.Yu. Rusin. J. Phys. Chem. 99, 15502 (1995). https://doi.org/10.1021/j100042a026
- L.Yu. Rusin, Izv. Akad. Nauk, Energet., No. 1, 41 (1997).
- V.M. Azriel’, D.B. Kabanov, L.I. Kolesnikova, and L.Yu. Rusin, Izv. Akad. Nauk, Energet., No. 5, 50 (2007).
- V.M. Azriel’, D.B. Kabanov, and L.Yu. Rusin. Russ. J. Phys. Chem. B 5, 177 (2011). https://doi.org/10.1134/S1990793111020175
- V.M. Azriel’, V.M. Akimov, E.V. Ermolova et al. Prikl. Fiz. Mat., No. 2, 30 (2018).
- V.M. Azriel’. Candidate’s Dissertation in Chemistry (Inst. Energy Probl. Chem. Phys. AS USSR, Moscow, 1990).
- L.Yu. Rusin. Doctoral Dissertation in Physics and Mathematics (Inst. Energy Probl. Chem. Phys. AS USSR, Moscow, 1991).
- M.B. Sevryuk. Doctoral Dissertation in Physics and Mathematics (Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2003).
- E.V. Ermolova, Candidate’s Dissertation in Physics and Mathematics (Tal’rose Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2013).
- L.Yu. Rusin, M.B. Sevryuk, V.M. Azriel’, V. M. Akimov, and D.B. Kabanov. TsITiS Report No. 216032240003 (Tal’rose Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2016).
- V.M. Azriel’ and L.Yu. Rusin, Russ. J. Phys. Chem. B 2, 499 (2008). https://doi.org/10.1134/S1990793108040015
- V.M. Azriel’, E.V. Kolesnikova, L.Yu. Rusin, and M.B. Sevryuk. J. Phys. Chem. A 115, 7055 (2011). https://doi.org/10.1021/jp112344j
- D.B. Kabanov and L.Yu. Rusin. Chem. Phys. 392, 149 (2012). https://doi.org/10.1016/j.chemphys.2011.11.009
- D.B. Kabanov and L.Yu. Rusin. Russ. J. Phys. Chem. B 6, 475 (2012). https://doi.org/10.1134/S1990793112040033
- E.V. Kolesnikova and L.Yu. Rusin. Russ. J. Phys. Chem. B 6, 583 (2012). https://doi.org/10.1134/S1990793112050156
- V.M. Azriel’, L.Yu. Rusin, and M.B. Sevryuk. Chem. Phys. 411, 26 (2013). https://doi.org/10.1016/j.chemphys.2012.11.016
- E.V. Ermolova and L.Yu. Rusin. Russ. J. Phys. Chem. B 8, 261 (2014). https://doi.org/10.1134/S199079311403004X
- V.M. Azriel’, L.I. Kolesnikova, and L.Yu. Rusin. Russ. J. Phys. Chem. B 10, 553 (2016). https://doi.org/10.1134/S1990793116040205
- V.M. Azriel’, V.M. Akimov, E.V. Ermolova, D.B. Kabanov, L.I. Kolesnikova, L.Yu. Rusin, and M.B. Sevryuk. Russ. J. Phys. Chem. B 12, 957 (2018). https://doi.org/10.1134/S1990793118060131
- P. Brumer and M. Karplus. J. Chem. Phys. 58, 3903 (1973). https://doi.org/10.1063/1.1679747
- P. Brumer, Phys. Rev. A 10, 1 (1974). https://doi.org/10.1103/PhysRevA.10.1
- F.P. Tully, N.H. Cheung, H. Haberland, and Y.T. Lee. J. Chem. Phys. 73, 4460 (1980). https://doi.org/10.1063/1.440683
- E.S. Rittner. J. Chem. Phys. 19, 1030 (1951). https://doi.org/10.1063/1.1748448
- L.V. Lenin and L.Yu. Rusin, Chem. Phys. Lett. 175, 608 (1990). https://doi.org/10.1016/0009-2614(90)85589-5
- L.Yu. Rusin and M.B. Sevryuk. TsITiS Report No. AAAA-B16-216092340017-7 (Tal’rose Inst. Energy Probl. Chem. Phys. RAS, Moscow, 2016).
- A.A. Zembekov and F. Shnaider, Sov. J. Chem. Phys. 5, 2681 (1990).
- T.L. Gilbert, O. C. Simpson, and M. A. Williamson. J. Chem. Phys. 63, 4061 (1975). https://doi.org/10.1063/1.431848
- C.C. Kirkpatrick and L.A. Viehland. Chem. Phys. 98, 221 (1985). https://doi.org/10.1016/0301-0104(85)80135-X
- D.R. Lamm, R.D. Chelf, J.R. Twist et al. J. Chem. Phys. 79, 1965 (1983). https://doi.org/10.1063/1.445977
- E.K. Parks and S. Wexler, J. Phys. Chem. 88, 4492 (1984). https://doi.org/10.1021/j150664a009
- I.R. Gatland, M.G. Thackston, W. M. Pope, et al., J. Chem. Phys. 68, 2775 (1978). https://doi.org/10.1063/1.436069
- L.A. Viehland. Chem. Phys. 85, 291 (1984). https://doi.org/10.1016/0301-0104(84)85040-5
- V.M. Azriel’, V.M. Akimov, L.Yu. Rusin, and M.B. Sevryuk. Russ. J. Phys. Chem. B 4, 353 (2010). https://doi.org/10.1134/S1990793110030012
- L.I. Kolesnikova, L.Yu. Rusin, and M.B. Sevryuk. Russ. J. Phys. Chem. B 9, 849 (2015). https://doi.org/10.1134/S1990793115060160
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