Dataset Open Access
Lokamani, Mani;
Kilibarda, Filip;
Günther, Florian;
Kelling, Jeffrey;
Strobel, Alexander;
Zahn, Peter;
Juckeland, Guido;
Gothelf, Kurt;
Scheer, Elke;
Gemming, Sibylle;
Erbe, Artur
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<dct:title>Data publication: Static and dynamic simulation approach using density-functional tight-binding in molecular electronics</dct:title>
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