Our lectures and oral reports on international and all-russian conferences
during last years.
- Report on Шестая Российская конференция по радиохимии “Радиохимия-2009”, 12-16 октября
A.V.Zaitsevski, A.V. Titov
"Релятивистская теория функционала плотности и моделирование химических свойств сверхтяжелых элементов",
Oral report (Pdf file in Russian).
- Report on Шестая Российская конференция по радиохимии “Радиохимия-2009”, 12-16 октября
A.V. Titov, N.S.Mosyagin, A.N.Petrov, A.V.Zaitsevski
"Неэмпирические расчеты электронной структуры и свойств соединений сверхтяжелых элементов"
Thesis (Pdf file in Russian).
- Report on 12-th V.A. Fock Meeting on Quantum and Computational Chemistry (2009)
A.V.Zaitsevski, A.V. Titov
"Interaction of element 112 with gold: DFT versus many-body description",
online link
- Reports on XXI-th Russian Symposium "Modern Chemical Physics" (Tuapse,
Russia, 25 September - 8 October 2009) http://www.chph.ras.ru/~tuapse
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, A.V. Zaitsevskii,
"ИССЛЕДОВАНИЕ ХИМИИ СВЕРХТЯЖЕЛЫХ ЭЛЕМЕНТОВ: НЕЭМПИРИЧЕСКИЕ РАСЧЕТЫ", Oral report (Pdf file in Russian).
- A.N. Petrov, N.S. Mosyagin, L.V. Skripnikov and A.V. Titov,
"ДВУХШАГОВЫЙ МЕТОД РАСЧЕТА ОСТОВНЫХ СВОЙСТВ МОЛЕКУЛ СОДЕРЖАЩИХ ТЯЖЕЛЫЕ АТОМЫ", Oral report (Pdf file in Russian)
- A.V. Zaitsevskii, A.V.Titov, E.A.Rykova
"КЛАСТЕРНОЕ МОДЕЛИРОВАНИЕ АДСОРБЦИИ СВЕРХТЯЖЕЛЫХ ЭЛЕМЕНТОВ НА ПОВЕРХНОСТИ ЗОЛОТА МЕТОДАМИ РЕЛЯТИВИСТСКОЙ ТЕОРИИ ФУНКЦИОНАЛА ПЛОТНОСТИ", Oral report (Pdf file in Russian).
- L.V.Skripnikov, A.V. Titov
"Неэмпирический расчёт спектроскопических свойств PtH+",
International Conference on Chemistry
“Main Trends of Chemistry at the Beginning of XXI Century”,
devoted to the 175th anniversary of birthday of D.I. Mendeleev and 80th anniversary of foundation of
Department of Chemistry of St. Petersburg State University (April 21–24, 2009 Saint-Petersburg, RUSSIA)
Oral report (Rtf file in Russian).
- A.V.Zaitsevskii, Ch. van Wuellen, N.S.Mosyagin, A.N.Petrov and A.V.Titov
"Chemistry of superheavy elements eka-Hg (E112) and eka-Pb (E114): Theoretical and experimental investigations",
Lecture on XLIII PNPI winter School (Repino, Russia, 24 February - 01 March 2009)
http://http://dbserv.pnpi.spb.ru/WinterSchool
- A.V.Zaitsevskii, E.A.Rykova, Ch. van Wuellen, N.S.Mosyagin, A.N.Petrov and A.V.Titov (lecturer)
"Accurate relativistic pseudopotential model for SHEs: applications to the chemistry of eka-Hg and eka-Pb",
Invited talk on the International Symposium "Periodic Table of D.I. Mendeleev. The new superheavy elements"
(Dubna, Russia, 20-21 January, 2009)
http://flerovlab.jinr.ru/flnr/flnr_conf_dim_175.html
- Reports on XX-th Russian Symposium "Modern Chemical Physics" (Tuapse,
Russia, 15--25 September 2008) http://www.chph.ras.ru/~tuapse
- N.S.Mosyagin, A.V.Titov and A.N.Petrov,
"Современное состояние теории псевдопотенциала остова",
Oral report (Rtf file in Russian).
- A.V.Titov,
N.S.Mosyagin, A.N.Petrov, A.V. Zaitsevskii and E.A. Rykova,
"Исследование свойств сверхтяжёлых элементов",
Oral report (Rtf file in Russian).
- A.N. Petrov, N.S. Mosyagin and A.V. Titov,
"Проверка теорий фундаментальных взаимодействий методами молекулярной спектроскопии",
Oral report (Rtf file in Russian)
"III премия на конкурсе лучших работ"
- Report on XLII PNPI winter School (Repino, 17-24 February 2008, Russia)
http://hepd.pnpi.spb.ru/WinterSchool/prog/time-table-08.html
- A.V.Titov,
N.S.Mosyagin and A.N.Petrov,
"Эффективные потенциалы остова +",
Lecture
- Report on XLI PNPI winter School (Repino, 19 February - 02 March 2007, Russia)
http://hepd.pnpi.spb.ru/WinterSchool/prog/time-table-07.html
- Мосягин Н.С., Петров А.Н., Исаев Т.А., Титов А.В., Зайцевский А.В. and Рыкова Е.А.
"Теоретическое исследование химии сверхтяжелого элемента 112 (эка-ртути) и эксперименты с изотопами E112 из `острова стабильности' ”
Lecture
- Report on 43rd Symposium on Theoretical Chemistry (Saarbrücken, Germany, 2007), C3
- Titov A.V., Mosyagin N.S., Petrov A.N. and Isaev T.A.,
"Combined ab initio methods and accurate study of heavy-atom molecules to search for new physics beyond the Standard model",
Oral report
- Report on international conference on the chemistry and physics of the transactinide elements (TAN07) (PSI, Villigen, Davos, Switzerland, 2007), 39.
- Titov A.V., Mosyagin N.S., Petrov A.N., Isaev T.A., Zaitsevskii A.V., Rykova E.A.,
"Theoretical study of chemistry of element 112 (eka-Hg)",
Oral report
- Report on Сб. аннотаций докладов конференции по физике конденсированного состояния, сверхпроводимости и материаловедению. Посвящается 50-летию исследовательского ядерного реактора ИРТ (РНЦ Курчатовский институт, Москва, 2007), 132.
- Зайцевский А.В., Русаков А.А., Рыкова Е.А. and Титов А.В.,
"Моделирование электронного строения малых кластеров золота и их взаимодействия с атомами сверхтяжелых элементов: релятивистские эффекты и электронная корреляция",
Oral report
- Report on 11-th V.A.Fock school on Quantum and Computational Chemistry (Anapa, RUSSIA, 2007), 19.
- Petrov A.N., Mosyagin N.S., Isaev T.A., Titov A.V.,
"Towards the electron EDM search: Theoretical study of HfF",
Electronic report
- Talk on V-th Russian conference on radiochemistry ``Radochemistry-2006''
(JINR, Dubna, 23--27 Oktober 2006, Russia)
- E.A. Rykova, A.V. Zaitsevskii, T.A. Isaev, N.S. Mosyagin and A.V. Titov
"Quantum-chemical modeling of adsorption of the eka-Hg atoms on the
gold surface: calculations of systems Hg-Aun and E112-Aun by
the relativistic density functional method",
Proceedings web site
Oral talk.
- Talks on
XI-th European Workshop on Quantum Systems in Chemistry
Physics (QSCP-XI) (St.-Petersburg, 20-25 August 2006, Russia)
- A.V. Titov, N.S. Mosyagin, A.N. Petrov and T.A. Isaev
New generation of the electron electric dipole moment experiments:
Importance of accurate ab initio calculations on heavy-atom
molecules.
Conference web site
Plenary talk.
- A.V. Zaitsevskii, N.S. Mosyagin, A.V. Titov and E.A. Rykova
Influence of spin-dependent interactions on chemical bonding in
superheavy element compounds: E112(eka-Hg) versus Hg.
Conference web site
Plenary talk.
- Report on X Fock Conference on Quantum and Computational Chemistry
(Kazan, 10-14 July 2006, Russia)
- Mosyagin N.S., Titov A.V., Petrov A.N., Isaev T.A., Zaitsevskii A.V., Rykova E.A.
Is element 112 (eka-mercury) a relatively inert one?
Relativistic correlation calculations of spectroscopic constants for
the E112 vs. Hg compounds.
Abstract
Plenary lecture.
- Report on Enlarged Meeting of the Bureau of the
Interdepartmental Scientific Council on Radiochemistry
under the Presidium of the RAS and the Federal Agency for Atomic Energy:
(Moscow, 12 April 2006, Russia). Announcement.
- N.S. Mosyagin, A.N. Petrov, T.A.Isaev, A.V. Titov, A.V. Zaitsevskii
and E.A. Rykova
"On chemical identification of E112 (eka-mercury): Is E112 relatively
inert element? Precise calculations of E112 and Hg compounds",
PDF file (Russian)
Oral report.
- Report on XL PNPI winter School (Repino, 20-26 February 2006, Russia) Web site.
- A.V.Titov, A.N.Petrov, N.S. Mosyagin and T.A.Isaev,
Search for electron EDM in molecular experiments:
new objects and importance of precise calculations.
PDF file
Oral report.
- A.V.Titov, N.S.Mosyagin, A.N.Petrov and T.A.Isaev (PNPI);
A.V.Zaitsevskii and E.A.Rykova (Kinetics Technology Ltd.)
On the chemical identification of E112: is E112 a relatively
inert element? Precise calculations of E112 compounds.
PDF file
Oral report
- Report on PANIC'05 International Conference
(Santa Fe, 24-28 Oktober 2005, USA)
Web site.
- T.A.Isaev, A.N.Petrov, N.S. Mosyagin and A.V.Titov
Prospective candidates for the EDM experiments of new type:
calculations of enhancement of P,T-odd effects in HI+ and liquid Xe.
PDF file
Oral report.
- Report on V International Workshop "Ultracold and Cold Neutrons. Physics and
Sources." (Peterhof, 13-18 July 2005, Russia)
Web site.
- A.V.Titov
Ab initio study of P,T-parity violation effects in polar heavy-atom
molecules.
PDF file
Lecture.
- Report on IX Fock Conference on Quantum and Computational Chemistry (Novgorod
the Great, 10-14 May 2005, Russia)
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, and T.A.Isaev
Accurate accounting for correlation in heavy-atom systems:
atoms and few-atom molecules.
Abstract
Lecture.
- Report on XXXIX PNPI Winter School (St-Petersburg,
14-21 February 2005)
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, and T.A.Isaev
Two-step method and calculation of P,T-parity violation effects in polar heavy-atom molecules.
Abstract
Lecture.
- Report on Quantum Systems in Chemistry and Physics QSCP-IX (Les Houches,
25-30 September 2004)
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, and T.A.Isaev
Calculation of P,T-parity violation effects in heavy-atom molecules.
Abstract
Oral talk.
- Reports on VII Fock School on Quantum and Computational Chemistry (Novgorod
the Great, 25-30 April 2004) Web site.
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, and T.A.Isaev
Two-step method for precise calculation of core properties in molecules.
Abstract
Plenary lecture.
- Anatoly V. Titov and Nikolai S. Mosyagin
Relativistic effective core potentials providing ``chemical accuracy''
in calculation of heavy-atom compounds.
Oral talk on the REHE-2003 ("Relativistic Effects in Heavy-Element
Chemistry" (satellite meeting to the International Congress of Quantum
Chemistry ICQC 2003 in Bonn)), Berlin, Germany, July 28-30, 2003.
Abstract
- Short talks on the Satellite Workshop of the XIth International Congress
of Quantum Chemistry (Pseudopotentials and Reactions.100 Years Hellmann
(1903-1938)), Bonn, Germany, July 25-26, 2003.
- N.S.Mosyagin, A.V.Titov:
Generalized Relativistic Effective Core Potentials for Superheavy
Elements.
Abstract
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, T.A.Isaev
Two-step High-precision Calculation of PNC-effects in Heavy-atom
Molecules.
Abstract
- Report on the DAMOP2003 meeting (Boulder, USA, 20-24 May 2003)
- A.V.Titov, N.S.Mosyagin, A.N.Petrov, T.A. Isaev,
Two-step method and high-precision calculation of PNC effects in
heavy-atom molecules.
Abstract.
- Reports on VI Fock School on Quantum and Computational Chemistry (Novgorod
the Great, 12-16 May 2003)
Web site.
- T.A.Isaev, A.N.Petrov, N.S.Mosyagin, A.V.Titov, E.Eliav and U.Kaldor
Ab initio calculation of P,T-odd effects in low-lying excited states
of 207PbO.
http://qcc.ru/%7Efock/proceedings/801/
Oral talk
- A. V. Titov
Relativistic effective core potentials providing 'chemical accuracy'
in calculation of heavy-atom compounds.
Plenary lecture.
- Abstract.
- A.V.Titov,
Accuracy and efficiency of modern methods for electronic structure
calculation on heavy- and superheavy-element compounds,
Talk on VII International School-Seminar on Heavy Ion Physics. (Dubna.
Russia, 27 May -- 1 June 2002),
Web site.
- Reports on V Fock School on Quantum and Computational Chemistry (Novgorod
the Great, 13-18 May 2002),
Web site.
- A.V.Titov,
Introduction to coupled cluster theory,
Plenary lecture.
- I.I.Tupitsyn, A.N.Petrov,
Self-consistent field calculations of heavy atoms including the
Breit interaction,
PDF file.
- Reports on VI Scientific Conference of Young Scientists and Specialists
(Dubna, 4-9 February 2002), http://ayss.jinr.ru/conf/conf02/conf02.htm,
- A.V.Titov, N.S.Mosyagin,
Search for P,T-noninvariance (in neutrons, atoms and molecules).
Modern methods for electronic structure calculation of (super)heavy-element
compounds,
Plenary
lecture.
- T.A.Isaev, N.S.Mosyagin, A.N.Petrov, A.V.Titov,
Ab initio calculation of the electronic EDM enchancement factor
in the metastable a(1) and B(1) states of the PbO molecule including correlations.
Planned experiments on EDM search in optical cells.
Oral
report. Thesis
(Postscript file in Russian)."The best panel
report" award.
- N.S.Mosyagin, M.G.Kozlov, A.V.Titov,
Ab initio calculation of the parameters of the P,T-odd spin-rotational
Hamiltonian for the YbF molecule.
Oral
report.Thesis
(Word file in Russian).
- A.N. Petrov, N.S. Mosyagin, T.A. Isaev, A.V. Titov, V.F. Ezhov, E.Eliav,
U.Kaldor,
Calculation of the P,T-odd effects in the TlF molecule including
electron correlation,
Oral
report.Thesis
(Word file in Russian).
- A.V.Titov, N.S.Mosyagin,
Modern methods for electronic structure calculation of heavy-element
compounds,
Lecture on XIII-th Russian Symposium ``Modern Chemical Physics'' (Tuapse,
Russia, 20 September -- 01 October 2001),
http://cc.nifhi.ac.ru/~chemphys/tuapse/tuapse2001/ .
- N.S.Mosyagin, A.V.Titov, E.Eliav, U.Kaldor,
Generalized Relativistic Effective Core Potential and Relativistic
Coupled Cluster methods for precise electronic structure calculations.
Calculations on mercury hydride and its ion,
Oral report on XIII-th Russian Symposium ``Modern Chemical Physics''
(Tuapse, Russia, 20 September -- 01 October 2001),
http://cc.nifhi.ac.ru/~chemphys/tuapse/tuapse2001/ .
- A.N.Petrov, N.S.Mosyagin, T.A.Isaev, A.V.Titov, V.F.Ezhov, E.Eliav, and
U.Kaldor,
GRECP/RCC-SD calculation of the P,T-odd interaction parameters in
the TlF molecule,
Oral report on 3rd V.A.Fock school on Quantum and Computational Chemistry
(21-25 May 2001, Yaroslav the Wise University, Novgorod the Great, RUSSIA).
- N.S.Mosyagin, A.V.Titov, E.Eliav, U.Kaldor,
Generalized Relativistic Effective Core Potential and Relativistic
Coupled Cluster methods for precise electronic structure calculations.
Calculations on mercury hydride and its ion,
Oral report on 3rd V.A.Fock school on Quantum and Computational Chemistry
(21-25 May 2001, Yaroslav the Wise University, Novgorod the Great, RUSSIA).
Electronic poster in HTML
format.
- A.V.Titov and N.S.Mosyagin,
Generalized Relativistic Effective Core Potential Method: Theory
and Calculations,
Lecture on 2nd V.A.Fock school on Quantum and Computational Chemistry
(Yaroslav the Wise University of Novgorod, 31 January - 4 February 2000,
Novgorod the Great, RUSSIA).
- N.S.Mosyagin, E.Eliav, A.V.Titov, and U.Kaldor,
Comparison of relativistic effective core potential and all-electron
Dirac-Coulomb calculations of mercury transition energies by the relativistic
coupled cluster method,
Oral report on XI-th Russian Symposium "Modern Chemical Physics" (Tuapse,
Russia, 18-29 September 1999);
http://cc.nifhi.ac.ru/~chemphys/tuapse/tuapse99/ ;
http://195.19.74.131/~chemphys/tuapse99/index.html .
- A.V.Titov and N.S.Mosyagin,
Generalized Relativistic Effective Core Potential Method: Theory
and Calculations,
Oral report on XI-th Russian Symposium "Modern Chemical Physics" (Tuapse,
Russia, 18-29 September 1999);
http://cc.nifhi.ac.ru/~chemphys/tuapse/tuapse99/;
http://195.19.74.131/~chemphys/tuapse99/index.html .
- A.V.Titov and N.S.Mosyagin,
GRECP method and procedures of electronic structure restoration
in cores of heavy-atom systems,
Invited talk on the European Research Conference "Relativistic Quantum
Chemistry - Progress and Prospects" (Acquafredda di Maratea, Italy, 10-15
April 1999), p.41 (report s27).
http://hydra.chem.rug.nl/REHE/titov.html.
Go to "Recent Posters"