Počet záznamů: 1
Singlet L-a and L-b Bands for N-Acenes (N = 2-7): A CASSCF/CASPT2 Study
SYS 0479628 LBL 01000a^^22220027750^450 005 20240103214714.5 014 $a 85029222760 $2 SCOPUS 014 $a 28719203 $2 PUBMED 014 $a 000410867500031 $2 WOS 017 $a 10.1021/acs.jctc.7b00302 $2 DOI 100 $a 20171016d m y slo 03 ba 101 $a eng $d eng 102 $a US 200 1-
$a Singlet L-a and L-b Bands for N-Acenes (N = 2-7): A CASSCF/CASPT2 Study 215 $a 10 s. 463 -1
$1 001 cav_un_epca*0039629 $1 011 $a 1549-9618 $e 1549-9626 $1 200 1 $a Journal of Chemical Theory and Computation $v Roč. 13, č. 9 (2017), s. 4297-4306 $1 210 $c American Chemical Society 610 $a polycyclic aromatic hydrocarbons 610 $a density functional theory 610 $a theory/multireference configuration interaction 700 -1
$3 cav_un_auth*0351572 $4 070 $a Bettanin $b F. $y BR 701 -1
$3 cav_un_auth*0351573 $4 070 $a Ferrao $b L. F. A. $y BR $z K 701 -1
$3 cav_un_auth*0351574 $4 070 $a Pinheiro Jr. $b M. $y BR 701 -1
$3 cav_un_auth*0351575 $4 070 $a Aquino $b A. J. A. $y US 701 -1
$3 cav_un_auth*0310470 $4 070 $a Lischka $b H. $y US 701 -1
$3 cav_un_auth*0351576 $4 070 $a Machado $b F. B. C. $y BR $z K 701 -1
$3 cav_un_auth*0107598 $i Nekovalentní interakce $j Non-Covalent Interactions $k 610/61 $l 610/61 $w Molecular modeling and spectroscopy in chemistry and biology $4 070 $a Nachtigallová $b Dana $p UOCHB-X $z K $T Ústav organické chemie a biochemie AV ČR, v. v. i.
Počet záznamů: 1