About: Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions     Goto   Sponge   NotDistinct   Permalink

An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

AttributesValues
rdf:type
Description
  • IR, Ramanova a ROA spectra jsou analyzována s důrazem na modelování silového pole. Harmonické frekvence získané 25 ab initio metodami jsou srovnány s experimentem. Role anharmonických interakcí v potenciálu a intenzitě je systematicky mapována pomocí self=konzistentního pole a vibrační konfihurační interakce. (cs)
  • IR, Raman, and ROA spectra are analyzed with the emphasis on the force field modeling. Vibrational harmonic frequencies obtained with 25 ab initio methods are compared to experimental band positions. The role of anharmonic terms in the potential and intensity tensors is also systematically explored using the vibrational self-consistent field, vibrational configuration interaction.
  • IR, Raman, and ROA spectra are analyzed with the emphasis on the force field modeling. Vibrational harmonic frequencies obtained with 25 ab initio methods are compared to experimental band positions. The role of anharmonic terms in the potential and intensity tensors is also systematically explored using the vibrational self-consistent field, vibrational configuration interaction. (en)
Title
  • Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions
  • Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions (en)
  • Anharmonické efekty v IR, Ramanových a opticky aktivních spektrech alaninového a prolinového zwitteriontu (cs)
skos:prefLabel
  • Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions
  • Anharmonic effects in IR, Raman, and Raman optical activity spectra of alanine and proline zwitterions (en)
  • Anharmonické efekty v IR, Ramanových a opticky aktivních spektrech alaninového a prolinového zwitteriontu (cs)
skos:notation
  • RIV/61388963:_____/07:00087190!RIV08-AV0-61388963
http://linked.open.../vavai/riv/strany
  • 224513;1
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(GA202/07/0732), P(GA203/06/0420), P(IAA400550702), Z(AV0Z40550506), Z(MSM0021620835)
http://linked.open...iv/cisloPeriodika
  • 22
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
  • 410039
http://linked.open...ai/riv/idVysledku
  • RIV/61388963:_____/07:00087190
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • IR; Raman; ROA spectra; Anharmonic effects (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...odStatuVydavatele
  • US - Spojené státy americké
http://linked.open...ontrolniKodProRIV
  • [3DA5ED8569B5]
http://linked.open...i/riv/nazevZdroje
  • Journal of Chemical Physics
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
  • 126
http://linked.open...iv/tvurceVysledku
  • Bednárová, Lucie
  • Bouř, Petr
  • Kopecký, V.
  • Kapitán, Josef
  • Baumruk, V.
  • Daněček, Petr
http://linked.open...n/vavai/riv/zamer
issn
  • 0021-9606
number of pages
Faceted Search & Find service v1.16.118 as of Jun 21 2024


Alternative Linked Data Documents: ODE     Content Formats:   [cxml] [csv]     RDF   [text] [turtle] [ld+json] [rdf+json] [rdf+xml]     ODATA   [atom+xml] [odata+json]     Microdata   [microdata+json] [html]    About   
This material is Open Knowledge   W3C Semantic Web Technology [RDF Data] Valid XHTML + RDFa
OpenLink Virtuoso version 07.20.3240 as of Jun 21 2024, on Linux (x86_64-pc-linux-gnu), Single-Server Edition (126 GB total memory, 48 GB memory in use)
Data on this page belongs to its respective rights holders.
Virtuoso Faceted Browser Copyright © 2009-2024 OpenLink Software