Synonyme wurden verwendet für: Density Functional Theory
Suche ohne Synonyme: keywords:("Density Functional Theory")

1–7 von 7 Ergebnissen
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    Next generation interatomic potentials for condensed systems

    Handley, Christopher Michael / Behler, Jörg | Tema Archiv | 2014
    Schlagwörter: Dichte-Funktional-Theorie

    Some new reaction pathways for the formation of cytosine in interstellar space – A quantum chemical study

    Gupta, V.P. / Tandon, Poonam / Mishra, Priti | Elsevier | 2012
    Schlagwörter: Density functional theory

    Copper–antimony–red phosphorus composites as promising anode materials for sodium-ion batteries

    Mun, Yoo Seok | Online Contents | 2017
    Schlagwörter: Density functional theory

    Environmental tight-binding modeling of nickel and cobalt clusters

    McEniry, Eunan J. / Drautz, Ralf / Madsen, Georg K.H. | Tema Archiv | 2013
    Schlagwörter: Dichtefunktionaltheorie

    Atomic oxygen influence on nanostructures

    Voronina, E.N. / Novikov, L.S. | Tema Archiv | 2012
    Schlagwörter: Dichtefunktionaltheorie

    The possible roles of stoichiometry, microstructure, and defects on the mechanical behavior of boron carbide

    McCuiston, Ryan / Lasalvia, Jerry / McCauley, James et al. | Tema Archiv | 2009
    Schlagwörter: Dichtefunktionstheorie

    First-principles study of structural, electronic, and mechanical properties of the nanolaminate compound Ti4GeC3 under pressure

    Li, Chenliang / Wang, Zhenqing | Tema Archiv | 2010
    Schlagwörter: Dichtefunktionstheorie