Počet záznamů: 1
Calculation of transition matrix elements by nonsingular orbital transformations
SYS 0326970 LBL 01435^^^^^2200325^^^450 005 20240103191849.1 014 $a 000264573900005 $2 WOS 017 $a 10.1002/qua.21935 $2 DOI 100 $a 20100311d m y slo 03 ba 101 0-
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$a Calculation of transition matrix elements by nonsingular orbital transformations 215 $a 28 s. 463 -1
$1 001 cav_un_epca*0256814 $1 011 $a 0020-7608 $e 1097-461X $1 200 1 $a International Journal of Quantum Chemistry $v Roč. 109, č. 6 (2009), s. 1200-1227 $1 210 $c Wiley 610 0-
$a full CI 610 0-
$a CASSGF 610 0-
$a CASSI 610 0-
$a corresponding orbital transformation 610 0-
$a localized 700 -1
$3 cav_un_auth*0103583 $a Kývala $b Mojmír $p UOCHB-X $w Molecular modeling and spectroscopy in chemistry and biology $z G $4 070 $T Ústav organické chemie a biochemie AV ČR, v. v. i.
Počet záznamů: 1