Ab Initio Study of Electronic States of Astrophysically Important Molecules

Bibliographische Detailangaben
Parent link:Russian Physics Journal.— , 1965-
Vol. 59, iss. 4.— 2016.— [P. 536–543]
Körperschaft: Национальный исследовательский Томский политехнический университет Институт физики высоких технологий Кафедра общей химии и химической технологии
Weitere Verfasser: Valiev R. R. Rashid Rinatovich, Berezhnoy A. A. Aleksey Alekseevich, Minaev B. F. Boris Filippovich, Chernov V. E. Vyacheslav Evgenjevich, Cherepanov V. N. Viktor Nikolaevich
Zusammenfassung:Title screen
A study of electronic states of LiO, NaO, KO, MgO, and CaO molecules has been performed. Potential energy curves of the investigated molecules have been constructed within the framework of the XMC-QDPT2 method. Lifetimes and efficiencies of photolysis mechanisms of these monoxides have been estimated within the framework of an analytical model of photolysis. The results obtained show that oxides of the considered elements in the exospheres of the Moon and Mercury are destroyed by solar photons during the first ballistic flight.
Режим доступа: по договору с организацией-держателем ресурса
Sprache:Englisch
Veröffentlicht: 2016
Schlagworte:
Online-Zugang:http://dx.doi.org/10.1007/s11182-016-0803-y
Format: Elektronisch Buchkapitel
KOHA link:https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=650974

MARC

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200 1 |a Ab Initio Study of Electronic States of Astrophysically Important Molecules  |f R. R. Valiev, A. A. Berezhnoy, B. F. Minaev [et al.] 
203 |a Text  |c electronic 
300 |a Title screen 
320 |a [References: 40 tit.] 
330 |a A study of electronic states of LiO, NaO, KO, MgO, and CaO molecules has been performed. Potential energy curves of the investigated molecules have been constructed within the framework of the XMC-QDPT2 method. Lifetimes and efficiencies of photolysis mechanisms of these monoxides have been estimated within the framework of an analytical model of photolysis. The results obtained show that oxides of the considered elements in the exospheres of the Moon and Mercury are destroyed by solar photons during the first ballistic flight. 
333 |a Режим доступа: по договору с организацией-держателем ресурса 
461 |t Russian Physics Journal  |d 1965- 
463 |t Vol. 59, iss. 4  |v [P. 536–543]  |d 2016 
610 1 |a электронный ресурс 
610 1 |a труды учёных ТПУ 
701 1 |a Valiev  |b R. R.  |c chemist  |c Assistant of Tomsk Polytechnic University  |f 1983-  |g Rashid Rinatovich  |3 (RuTPU)RU\TPU\pers\34114  |9 17654 
701 1 |a Berezhnoy  |b A. A.  |g Aleksey Alekseevich 
701 1 |a Minaev  |b B. F.  |g Boris Filippovich 
701 1 |a Chernov  |b V. E.  |g Vyacheslav Evgenjevich 
701 1 |a Cherepanov  |b V. N.  |g Viktor Nikolaevich 
712 0 2 |a Национальный исследовательский Томский политехнический университет  |b Институт физики высоких технологий  |b Кафедра общей химии и химической технологии  |3 (RuTPU)RU\TPU\col\21253  |9 27944 
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