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Statements

Subject Item
n2:RIV%2F61388963%3A_____%2F13%3A00421845%21RIV14-MSM-61388963
rdf:type
skos:Concept n7:Vysledek
dcterms:description
Extensive DFT calculations using the B3LYP and VSXC density functionals and recently modified STO-3Gel and STO- 3Gmag basis sets supported their potential use in theoretical works leading to predicting structural and NMR properties of model SWCNT systems. Extensive DFT calculations using the B3LYP and VSXC density functionals and recently modified STO-3Gel and STO- 3Gmag basis sets supported their potential use in theoretical works leading to predicting structural and NMR properties of model SWCNT systems.
dcterms:title
Efficient Modeling of NMR Parameters in Carbon Nanosystems Efficient Modeling of NMR Parameters in Carbon Nanosystems
skos:prefLabel
Efficient Modeling of NMR Parameters in Carbon Nanosystems Efficient Modeling of NMR Parameters in Carbon Nanosystems
skos:notation
RIV/61388963:_____/13:00421845!RIV14-MSM-61388963
n7:predkladatel
n8:ico%3A61388963
n4:aktivita
n18:P n18:I
n4:aktivity
I, P(GAP208/11/0105), P(LH11033)
n4:cisloPeriodika
9
n4:dodaniDat
n5:2014
n4:domaciTvurceVysledku
n10:8227322
n4:druhVysledku
n17:J
n4:duvernostUdaju
n16:S
n4:entitaPredkladatele
n13:predkladatel
n4:idSjednocenehoVysledku
72082
n4:idVysledku
RIV/61388963:_____/13:00421845
n4:jazykVysledku
n11:eng
n4:klicovaSlova
13C NMR; zigzag SWCNT; DFT
n4:klicoveSlovo
n15:DFT n15:13C%20NMR n15:zigzag%20SWCNT
n4:kodStatuVydavatele
US - Spojené státy americké
n4:kontrolniKodProRIV
[FFE1A41E8CDC]
n4:nazevZdroje
Journal of Chemical Theory and Computation
n4:obor
n9:CF
n4:pocetDomacichTvurcuVysledku
1
n4:pocetTvurcuVysledku
7
n4:projekt
n14:LH11033 n14:GAP208%2F11%2F0105
n4:rokUplatneniVysledku
n5:2013
n4:svazekPeriodika
9
n4:tvurceVysledku
Stachów, M. Stobinski, L. Stobinska, M. Pasterny, K. Kupka, T. Chelmecka, E. Kaminský, Jakub
n4:wos
000330096800042
s:issn
1549-9618
s:numberOfPages
12
n19:doi
10.1021/ct4002812