Quantum Transport Through Tunable Molecular Diodes

Abstract Employing self-interaction corrected density functional theory combined with the non-equilibrium Green’s function method, we study the quantum transport through molecules with different numbers of phenyl (donor) and pyrimidinyl (acceptor) rings in order to evaluate the effects of the molecu...

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Autores principales: Joshua Tobechukwu Obodo, Altynbek Murat, Udo Schwingenschlögl
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2017
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Acceso en línea:https://doaj.org/article/36743e54fcf6465eb4f88f3675ae2066
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