Number of the records: 1
Inclusion of mean-field spin–orbit effects based on all-electron two-component spinors: Pilot calculations on atomic and molecular properties
SYS 0164313 LBL 01404^^^^^2200229^^^450 005 20240121190831.6 100 $a 20120604d m y slo 03 ba 101 0-
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$a Inclusion of mean-field spin–orbit effects based on all-electron two-component spinors: Pilot calculations on atomic and molecular properties $d Zahrnutie spriemernených spin-orbitálnych efektov nad dvojkompoentnými spinormi: pilotné výpočty atómových a molekulových vlastností $f Miroslav Iliaš ... [et al.] $z slo 330 0-
$a Relativity is accounted for by Douglas–Kroll transformed one-electron operators: scalar (spin-free) and so called mean-field spin–orbit terms. The interelectronic interaction is represented by the nonrelativistic Coulomb operator. 463 -1
$1 001 umb_un_cat*0299631 $1 011 $a 0021-9606 $1 011 $a 1089-7690 $1 200 1 $a The Journal of Chemical Physics $v Vol. 115, no. 21 (2001), pp. 9667-9674 $1 210 $a New York $c American Institute of Physics $d 2001 606 0-
$3 umb_un_auth*0206343 $a mean-field spin-orbit effects 606 0-
$3 umb_un_auth*0206344 $a two-component spinors 606 0-
$3 umb_un_auth*0206345 $a molecular properties 615 $n 54 $a Chémia 675 $a 54 700 -1
$3 umb_un_auth*0173565 $a Iliaš $b Miroslav $f 1975- $p UMBFP08 $9 50 $4 070 $T Katedra chémie 701 -0
$3 umb_un_auth*0023061 $a Kellö $b Vladimír $4 070 $9 20 701 -1
$3 umb_un_auth*0180310 $a Visscher $b Lucas $4 070 $9 20 701 -1
$3 umb_un_auth*0206346 $a Schimmelpfennig $b Berndt $4 070 801 $a SK $b BB301 $g AACR2 $9 unimarc sk T85 $x existuji fulltexy
Number of the records: 1