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Naslov Exploring the applicability of density functional tight binding to transition metal ions. Parameterization for nickel with the spin-polarized DFTB3 model (Article)
Autori Vujovic Milena  Huynh Mioy Steiner Sebastian Garcia-Fernandez Pablo Elstner Marcus Cui Qiang Gruden Maja A  
Info JOURNAL OF COMPUTATIONAL CHEMISTRY, (2019), vol. 40 br. 2, str. 400-413
Projekat National Institute of General Medical Sciences [R01-GM106443]; Ramon y Cajal Grant [RyC-2013-12515]; Serbian Ministry of Science [172035]; Serbian-German collaboration project [451-03-01038/2015-09/7]; Spanish Ministry of Economy and Competitiveness [FIS2
Ispravka Web of Science   Članak   Elečas   Rang časopisa   Citati: Web of Science   Scopus  
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