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On the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems
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$a eng $d eng 102 $a HU 200 1-
$a On the optimization of the DF-SAPT-DFT interaction energies of hydrogen-bonded systems 215 $a 5 s. $c www 463 -1
$1 001 cav_un_epca*0329036 $1 010 $a 978-960-474-113-7 $1 200 1 $a Proceedings of the 5th WSEAS International Symposium on Simulation, Modelling and Optimization $v S. 237-241 $1 210 $a Budapest $c World Scientific and Engineering Academy and Society $d 2009 $1 225 $a Mathematics and Computers in Science and Engineering $1 702 1 $a Rudas $b I. $4 340 $1 702 1 $a Demiralp $b M. $4 340 $1 702 1 $a Mastorakis $b N. $4 340 541 1-
$a Optimalizace DF-SAPT-DFT interakčních energií systémů s vodíkovými vazbami $z cze 610 0-
$a optimization 610 0-
$a ab initio 610 0-
$a DFT 610 0-
$a interaction energy 700 -1
$3 cav_un_auth*0103007 $a Czernek $b Jiří $p UMCH-V $w Structure and dynamics of macromolecules $4 070 $T Ústav makromolekulární chemie AV ČR, v. v. i. 856 $q textový soubor $u http://www.wseas.us/books/2009/budapest/SMO.pdf
Number of the records: 1