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Physical Review Letters|May 13, 2011
Nonlocal screening of plasmons in graphene by semiconducting and metallic substrates: first-principles calculationsJun Yan, Kristian S Thygesen, Karsten W JacobsenThe Journal of Physical Chemistry Letters|November 4, 2016
Band Gap Tuning and Defect Tolerance of Atomically Thin Two-Dimensional Organic-Inorganic Halide PerovskitesMohnish Pandey, Karsten W Jacobsen, Kristian S ThygesenThe Journal of Physical Chemistry Letters|August 12, 2015
Two-Dimensional Metal Dichalcogenides and Oxides for Hydrogen Evolution: A Computational Screening ApproachMohnish Pandey, Aleksandra Vojvodic, Kristian S Thygesen, et al.Physical Review Letters|October 15, 2008
Anomalous conductance oscillations and half-metallicity in atomic Ag-O chainsMikkel Strange, Kristian S Thygesen, James P Sethna, et al.Nano Letters|March 31, 2016
Defect-Tolerant Monolayer Transition Metal DichalcogenidesMohnish Pandey, Filip A Rasmussen, Korina Kuhar, et al.The Journal of Chemical Physics|March 17, 2007
Nonequilibrium GW approach to quantum transport in nano-scale contactsKristian S Thygesen, Angel RubioBeilstein Journal of Nanotechnology|January 20, 2012
Towards quantitative accuracy in first-principles transport calculations: The GW method applied to alkane/gold junctionsMikkel Strange, Kristian S ThygesenJournal of the American Chemical Society|December 30, 2025
Defect-Assisted Recombination in Semiconductors and Photovoltaic Device Parameters from First PrinciplesJiban Kangsabanik, Kristian S ThygesenThe Journal of Chemical Physics|May 3, 2014
Static correlation beyond the random phase approximation: dissociating H2 with the Bethe-Salpeter equation and time-dependent GWThomas Olsen, Kristian S ThygesenPhysical Review Letters|March 5, 2009
Renormalization of molecular quasiparticle levels at metal-molecule interfaces: trends across binding regimesKristian S Thygesen, Angel RubioPageof 8