Search text:

Found: 7 publication items in all publications for the time range from: 1990 to: 2019 for:


    L.M. Ghiringhelli, C. Carbogno, S. Levchenko F. Mohamed, G. Huhs, M. Lueders, M. Oliveira, and M. Scheffler,
    ''Towards a Common Format for Computational Materials Science Data. Published as "Ψk Scientific Highlight of the Month", n. 131 (July 2016).
    Reprint download: pdf


    S. Bhattacharya, S. Levchenko L.M. Ghiringhelli and M. Scheffler,
    Efficient ab initio schemes for finding thermodynamically stable and metastable atomic structures: Benchmark of cascade genetic algorithms. New J. Phys. 16, 123016 (2014).
    Reprint download: pdf


    S. Bhattacharya, S. Levchenko L.M. Ghiringhelli, and M. Scheffler,
    Stability and Metastability of Clusters in a Reactive Atmosphere: Theoretical Evidence for Unexpected Stoichiometries of MgMOx. Phys. Rev. Lett. 111, 135501 (2013).
    Reprint download: pdf, Supplementary material: pdf
    N. Marom, R.A. DiStasio Jr., V. Atalla, S. Levchenko A.M. Reilly, J.R. Chelikowsky, L. Leiserowitz, and A. Tkatchenko,
    Many-Body Dispersion Interactions in Molecular Crystal Polymorphism. Angew. Chem. Int. Ed. 52, 6629-6632 (2013).
    Reprint download: pdf. DOI: 10.1002/anie.201301938.


    L.O. Paz-Borbón. G. Barcaro, A. Fortunelli, and S. Levchenko
    AuN clusters (N=1-6) supported on MgO(100) surfaces: Effect of exact exchange and dispersion interactions on adhesion energies. Phys. Rev. B 85, 155409 (2012).
    Reprint download: pdf


    S. Arndt, G. Laugel, S. Levchenko R. Horn, M. Baerns, M. Scheffler, R. Schlögl, and R. Schomäcker,
    "A critical assessment of Li/MgO-based catalysts for the oxidative coupling of methane". Cat. Rev. Science and Engineering 53, 424-514 (2011).
    Reprint download: pdf


    P. Myrach, N. Nilius, S. Levchenko A. Gonchar, T. Risse, K.-P. Dinse, L.A. Boatner, W. Frandsen, R. Horn, H.-J. Freund, R. Schlögl, and M. Scheffler,
    "Temperature-dependent morphology, magnetic, and optical properties of Li-doped MgO". ChemCatChem 2, 854-862 (2010).
    Reprint download: pdf