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A cluster model of liquid water and its IR spectroscopic response.
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http://linked.opendata.cz/ontology/domain/vavai/Vysledek
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http://linked.opendata.cz/ontology/domain/vavai/Vysledek
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http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description
IR spectra of liquid water were modeled for a cluster of 214 molecules, using combined MD and ab initio DFT-BPW91/6-31G ** computations.
IR spectra of liquid water were modeled for a cluster of 214 molecules, using combined MD and ab initio DFT-BPW91/6-31G ** computations.
(en)
Title
A cluster model of liquid water and its IR spectroscopic response.
A cluster model of liquid water and its IR spectroscopic response.
(en)
skos:prefLabel
A cluster model of liquid water and its IR spectroscopic response.
A cluster model of liquid water and its IR spectroscopic response.
(en)
skos:notation
RIV/61388963:_____/02:57020246!RIV/2003/AV0/A57003/N
http://linked.open.../vavai/riv/strany
82;88
http://linked.open...avai/riv/aktivita
P
Z
http://linked.open...avai/riv/aktivity
P(GA203/01/0031), P(IAA4055104), Z(AV0Z4055905)
http://linked.open...iv/cisloPeriodika
N/A
http://linked.open...vai/riv/dodaniDat
2003
http://linked.open...aciTvurceVysledku
Bouř, Petr
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
Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku
636938
http://linked.open...ai/riv/idVysledku
RIV/61388963:_____/02:57020246
http://linked.open...riv/jazykVysledku
eng - angličtina
http://linked.open.../riv/klicovaSlova
liquid water
(en)
http://linked.open.../riv/klicoveSlovo
liquid water
http://linked.open...odStatuVydavatele
NL - Nizozemsko
http://linked.open...ontrolniKodProRIV
[19ECD36EC48D]
http://linked.open...i/riv/nazevZdroje
Chemical Physics Letters
http://linked.open...in/vavai/riv/obor
CF
http://linked.open...ichTvurcuVysledku
1
(
xsd:int
)
http://linked.open...cetTvurcuVysledku
1
(
xsd:int
)
http://linked.open...ocetUcastnikuAkce
0
(
xsd:int
)
http://linked.open...nichUcastnikuAkce
0
(
xsd:int
)
http://linked.open...vavai/riv/projekt
Experimental and theoretical development of the Raman optical activity as a stereochemical probe for aqueous environment
Molecular Structural Studies with Circular-Dichroic and NMR Spectra
http://linked.open...UplatneniVysledku
2002
http://linked.open...v/svazekPeriodika
365
http://linked.open...iv/tvurceVysledku
Bouř, Petr
http://linked.open...n/vavai/riv/zamer
Chemical principles of selected biological phenomena in medicine and ecology
issn
0009-2614
number of pages
7
(
xsd:int
)
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