[DFTB-Plus-User] spin constant of Na

[Yusupov Maksudbek]

Dear Dr. Aradi,
dear all,

I am doing MD simulations (reaction of OH radical with biomolecule) using 3ob-3-1 parameter set.
My system consists of H, O, C, N, S and Na elements.
My question is where can I get the spin constants for Na?

Thanks in advance,
Maksud.

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dr. Maksudbek Yusupov
Research group PLASMANT, Department of Chemistry
University of Antwerp
Universiteitsplein 1
BE-2610 Wilrijk-Antwerp, Belgium
Tel: +32 3 265 23 82
Fax: +32 3 265 23 43
E-mail: maksudbek.yusupov at uantwerpen.be
Website: https://www.uantwerp.be/en/rg/plasmant/
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