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The Character of Low-Lying Excited States of Mixed-Ligand Metal Carbonyls. TD-DFT and CASSCF/CASPT2 Study of [W(CO)4L] (L = ethylenediamine, N, N'-di-alkyl-1,4-diazabutadiene) and [W(CO)5L] (L = pyridine, 4-cyanopyridine)
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$a eng 102 $a CZ 200 1-
$a The Character of Low-Lying Excited States of Mixed-Ligand Metal Carbonyls. TD-DFT and CASSCF/CASPT2 Study of [W(CO)4L] (L = ethylenediamine, N, N'-di-alkyl-1,4-diazabutadiene) and [W(CO)5L] (L = pyridine, 4-cyanopyridine) 215 $a 16 s. 463 -1
$1 001 cav_un_epca*0256425 $1 011 $a 0010-0765 $1 200 1 $a Collection of Czechoslovak Chemical Communications $v Roč. 68, č. 1 (2003), s. 89-104 $1 210 $c Ústav organické chemie a biochemie AV ČR, v. v. i. 610 1-
$a time dependent density functional 610 1-
$a UV-VIS spectroscopy 610 1-
$a DFT calculations 700 -1
$3 cav_un_auth*0102976 $a Záliš $b Stanislav $p UFCH-W $w Biophysical Chemistry $4 070 $T Ústav fyzikální chemie Jaroslava Heyrovského AV ČR, v. v. i. 701 -1
$3 cav_un_auth*0082507 $a Vlček $b Antonín $p UFCH-W $w Biophysical Chemistry $4 070 $T Ústav fyzikální chemie Jaroslava Heyrovského AV ČR, v. v. i. 701 -1
$3 cav_un_auth*0040895 $a Daniel $b CH. $y FR $4 070
Number of the records: 1