About: New Rotation-Vibration Band and Potential Energy Function of NeH+ in the Ground Electronic State     Goto   Sponge   NotDistinct   Permalink

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Description
  • Fourier transform emisní spektrum 20NeH+ v jeho elektronickém základním stavu bylo pozorováno v infračervené spektrální oblasti s neapodizovaným rozlišením 0.02 cm-1. Vlnočty pozorovaných linií byly určeny a fitovány v rámci Dunhamových expanzních koeficientů a metody redukovaných potenciálních křivek (RPC) s použitím ab-initio potenciálu. Celkem 122 linií bylo pozorováno a z nichž 40 bylo nových, včetně 4-3 vibračně rotačního pásu. Celková funkce potenciální energie získaná z pomocí RPC analýzy poskytuje velice blízký popis dat pro H+a D+ iontů v plynném neonu. (cs)
  • The Fourier transform emission spectrum of (NeH+)-Ne-20 in its (1)Sigma(+) ground electronic state was observed in the infrared spectral region at an apodized resolution of 0.02 cm(-1). The wavenumbers of the observed lines were assigned and fitted within the framework of the Dunham expansion and reduced potential curve (RPC) methods making use of ab initio potentials calculated to high accuracy. Of the total of 122 lines observed, 40 lines are newly assigned, including the new 4 --> 3 vibrational band. The global potential energy function arising from the RPC analysis provides a very close description of the mobility data for H+ and D+ ions in Ne gas and of the long-range induction interaction data thus indicating high reliability of its predictive power.
  • The Fourier transform emission spectrum of (NeH+)-Ne-20 in its (1)Sigma(+) ground electronic state was observed in the infrared spectral region at an apodized resolution of 0.02 cm(-1). The wavenumbers of the observed lines were assigned and fitted within the framework of the Dunham expansion and reduced potential curve (RPC) methods making use of ab initio potentials calculated to high accuracy. Of the total of 122 lines observed, 40 lines are newly assigned, including the new 4 --> 3 vibrational band. The global potential energy function arising from the RPC analysis provides a very close description of the mobility data for H+ and D+ ions in Ne gas and of the long-range induction interaction data thus indicating high reliability of its predictive power. (en)
Title
  • New Rotation-Vibration Band and Potential Energy Function of NeH+ in the Ground Electronic State
  • New Rotation-Vibration Band and Potential Energy Function of NeH+ in the Ground Electronic State (en)
  • Nový rotačně-vibrační pás a potenciální energetická funkce NeH+ v jeho základním stavu (cs)
skos:prefLabel
  • New Rotation-Vibration Band and Potential Energy Function of NeH+ in the Ground Electronic State
  • New Rotation-Vibration Band and Potential Energy Function of NeH+ in the Ground Electronic State (en)
  • Nový rotačně-vibrační pás a potenciální energetická funkce NeH+ v jeho základním stavu (cs)
skos:notation
  • RIV/61388955:_____/04:00101126!RIV/2005/AV0/A54005/N
http://linked.open.../vavai/riv/strany
  • 5;11
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GA203/01/0618), P(LN00A032), Z(AV0Z4040901)
http://linked.open...iv/cisloPeriodika
  • 1
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
http://linked.open.../riv/druhVysledku
http://linked.open...iv/duvernostUdaju
http://linked.open...titaPredkladatele
http://linked.open...dnocenehoVysledku
  • 576172
http://linked.open...ai/riv/idVysledku
  • RIV/61388955:_____/04:00101126
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • diatomic-molecules; curve method; spectra (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...odStatuVydavatele
  • NL - Nizozemsko
http://linked.open...ontrolniKodProRIV
  • [4B0B8A562478]
http://linked.open...i/riv/nazevZdroje
  • Journal of Molecular Structure
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...v/svazekPeriodika
  • 695-696
http://linked.open...iv/tvurceVysledku
  • Civiš, Svatopluk
  • Fišer, J.
  • Šebera, Jakub
  • Kawaguchi, K.
  • Špirko, Vladimír
  • Kraemer, W. P.
http://linked.open...n/vavai/riv/zamer
issn
  • 0022-2860
number of pages
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