Počet záznamů: 1
A comparison of density functional theory and coupled cluster methods for the calculation of electric dipole polarizability gradients of methane
SYS 0391792 LBL 02708^^^^^2200349^^^450 005 20240103202503.5 014 $a 000317113600092 $2 WOS 014 $a 84873155243 $2 SCOPUS 017 70
$a 10.1063/1.4771790 $2 DOI 100 $a 20140218d m y slo 03 ba 101 0-
$a eng 102 $a US 200 1-
$a A comparison of density functional theory and coupled cluster methods for the calculation of electric dipole polarizability gradients of methane 215 $a 4 s. $c P 463 -1
$1 001 cav_un_epca*0391791 $1 010 $a 978-0-7354-1122-7 $1 200 1 $a AIP Conference Proceedings $h 1504 $v S. 695-698 $1 210 $a Melville $c AIP $d 2012 610 0-
$a polarizability derivatives 610 0-
$a CH4 610 0-
$a DFT 700 -1
$3 cav_un_auth*0102892 $a Paidarová $b Ivana $i Odd. teoretické chemie $j Dept. of Theoretical Chemistry $p UFCH-W $w Theoretical and Computational Chemistry $4 070 $T Ústav fyzikální chemie Jaroslava Heyrovského AV ČR, v. v. i. 701 -1
$3 cav_un_auth*0082614 $a Sauer $b S. P. A. $y DK $4 070
Počet záznamů: 1