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Statements

Subject Item
n2:RIV%2F61388955%3A_____%2F01%3A54010025%21RIV%2F2003%2FAV0%2FA54003%2FN
rdf:type
skos:Concept n16:Vysledek
dcterms:description
The potential energy curves for the twisting of tetramethyleneethane in its lowest singlet and triplet states were calculated by the state-specific two-reference Brillouin-Wigner coupled-cluster method with single and double excitations. The potential energy curves for the twisting of tetramethyleneethane in its lowest singlet and triplet states were calculated by the state-specific two-reference Brillouin-Wigner coupled-cluster method with single and double excitations.
dcterms:title
State-Specific Brillouin-Wigner Multireference Coupled Cluster Study of the Singlet-Triplet Separation in the Tetramethyleneethane Diradical. State-Specific Brillouin-Wigner Multireference Coupled Cluster Study of the Singlet-Triplet Separation in the Tetramethyleneethane Diradical.
skos:prefLabel
State-Specific Brillouin-Wigner Multireference Coupled Cluster Study of the Singlet-Triplet Separation in the Tetramethyleneethane Diradical. State-Specific Brillouin-Wigner Multireference Coupled Cluster Study of the Singlet-Triplet Separation in the Tetramethyleneethane Diradical.
skos:notation
RIV/61388955:_____/01:54010025!RIV/2003/AV0/A54003/N
n3:strany
1354;1356
n3:aktivita
n10:P n10:Z
n3:aktivity
P(GA203/99/D009), P(OC D9.10), Z(AV0Z4040901)
n3:cisloPeriodika
8
n3:dodaniDat
n6:2003
n3:domaciTvurceVysledku
n13:9590439 n13:6643604 n13:1747681
n3:druhVysledku
n5:J
n3:duvernostUdaju
n15:S
n3:entitaPredkladatele
n7:predkladatel
n3:idSjednocenehoVysledku
697098
n3:idVysledku
RIV/61388955:_____/01:54010025
n3:jazykVysledku
n18:eng
n3:klicovaSlova
multireference coupled cluster; - Brillouin-Wigner; - tetramethyleneethane
n3:klicoveSlovo
n11:-%20Brillouin-Wigner n11:multireference%20coupled%20cluster n11:-%20tetramethyleneethane
n3:kodStatuVydavatele
US - Spojené státy americké
n3:kontrolniKodProRIV
[36212DEC89E8]
n3:nazevZdroje
Journal of Physical Chemistry. A
n3:obor
n14:CF
n3:pocetDomacichTvurcuVysledku
3
n3:pocetTvurcuVysledku
4
n3:pocetUcastnikuAkce
0
n3:pocetZahranicnichUcastnikuAkce
0
n3:projekt
n4:GA203%2F99%2FD009 n4:OC%20D9.10
n3:rokUplatneniVysledku
n6:2001
n3:svazekPeriodika
105
n3:tvurceVysledku
Pittner, Jiří Hubač, I. Nachtigall, Petr Čársky, Petr
n3:zamer
n17:AV0Z4040901
s:issn
1089-5639
s:numberOfPages
3