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Nonaqueous Ion Pairing Exemplifies the Case for Including Electronic Polarization in Molecular Dynamics Simulations
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$a 10.1021/acs.jpclett.3c02231 $2 DOI 100 $a 20231108d m y slo 03 ba 101 $a eng $d eng 102 $a US 200 1-
$a Nonaqueous Ion Pairing Exemplifies the Case for Including Electronic Polarization in Molecular Dynamics Simulations 215 $a 6 s. 463 -1
$1 001 cav_un_epca*0342500 $1 011 $a 1948-7185 $1 200 1 $a Journal of Physical Chemistry Letters $v Roč. 14, č. 39 (2023), s. 8691-8696 $1 210 $c American Chemical Society 608 $a Article 610 $a generalized gradient approximation 610 $a perturbation theory 700 -1
$3 cav_un_auth*0380857 $a Košťál $b Vojtěch $p UOCHB-X $i Molekulové modelování $j Molecular Modeling $k 630/63 $l 630/63 $y CZ $T Ústav organické chemie a biochemie AV ČR, v. v. i. 701 -1
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$3 cav_un_auth*0330501 $a Martinez-Seara $b Hector $p UOCHB-X $i Molekulové modelování $j Molecular Modeling $k 630/63 $l 630/63 $y ES $z K $T Ústav organické chemie a biochemie AV ČR, v. v. i. 856 $u https://doi.org/10.1021/acs.jpclett.3c02231 $9 RIV
Number of the records: 1