About: On the competition between linear and perpendicular isomers in photodynamics of cationic argon trimers

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Photoabsorption and subsequent photodissociation of two structural isomers of Ar3+ are studied via semiclassical non-adiabatic dynamics simulations. Several experimental observables are simulated under various plausible experimental conditions with the main emphasis on the differences between the data produced for the two isomers. They include photoabsorption cross section, total kinetic energy released, fragments kinetic energy distributions, and distribution of the total kinetic energy among photofragments represented via Dalitz plots. The ability of the parameters to discriminate between the two isomers is analyzed through a thorough comparison with available experimental data. We show that the recently recorded experimental Dalitz plots [V. Lepère, Y. J. Picard, M. Barat, J. A. Fayeton, B. Lucas, and K. Béroff, J. Chem. Phys. 130, 194301 (2009)] correspond to a hot mixture of distorted linear-like and perpendicular-like structures where linear-like structures prevail. Photoabsorption and subsequent photodissociation of two structural isomers of Ar3+ are studied via semiclassical non-adiabatic dynamics simulations. Several experimental observables are simulated under various plausible experimental conditions with the main emphasis on the differences between the data produced for the two isomers. They include photoabsorption cross section, total kinetic energy released, fragments kinetic energy distributions, and distribution of the total kinetic energy among photofragments represented via Dalitz plots. The ability of the parameters to discriminate between the two isomers is analyzed through a thorough comparison with available experimental data. We show that the recently recorded experimental Dalitz plots [V. Lepère, Y. J. Picard, M. Barat, J. A. Fayeton, B. Lucas, and K. Béroff, J. Chem. Phys. 130, 194301 (2009)] correspond to a hot mixture of distorted linear-like and perpendicular-like structures where linear-like structures prevail. (en)
Title	On the competition between linear and perpendicular isomers in photodynamics of cationic argon trimers On the competition between linear and perpendicular isomers in photodynamics of cationic argon trimers (en)
skos:prefLabel	On the competition between linear and perpendicular isomers in photodynamics of cationic argon trimers On the competition between linear and perpendicular isomers in photodynamics of cationic argon trimers (en)
skos:notation	RIV/61989100:27740/12:86084403!RIV13-MSM-27740___
http://linked.open...avai/riv/aktivita	P S Z
http://linked.open...avai/riv/aktivity	P(ED1.1.00/02.0070), S, Z(MSM6198910027)
http://linked.open...iv/cisloPeriodika	23
http://linked.open...vai/riv/dodaniDat	2013
http://linked.open...aciTvurceVysledku	Stachoň, Martin Kalus, René
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Vysoká škola báňská - Technická univerzita Ostrava / IT4Innovations
http://linked.open...dnocenehoVysledku	156366
http://linked.open...ai/riv/idVysledku	RIV/61989100:27740/12:86084403
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	positive ions; photodissociation; molecule-photon collisions; isomerism; argon (en)
http://linked.open.../riv/klicoveSlovo	argon photodissociation isomerism molecule-photon collisions positive ions
http://linked.open...odStatuVydavatele	US - Spojené státy americké
http://linked.open...ontrolniKodProRIV	[FA3D5B91045B]
http://linked.open...i/riv/nazevZdroje	Journal of Chemical Physics
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	2 (xsd:int)
http://linked.open...cetTvurcuVysledku	3 (xsd:int)
http://linked.open...vavai/riv/projekt	IT4Innovations Centre of Excellence
http://linked.open...UplatneniVysledku	2012
http://linked.open...v/svazekPeriodika	137
http://linked.open...iv/tvurceVysledku	Kalus, René Gadea, Florent X. Stachoň, Martin
http://linked.open...ain/vavai/riv/wos	000312780300025
http://linked.open...n/vavai/riv/zamer	Výpočetně náročné počítačové simulace a optimalizace
issn	0021-9606
number of pages	12 (xsd:int)
http://bibframe.org/vocab/doi	10.1063/1.4770228
http://localhost/t...ganizacniJednotka	27740

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