Comparing GIPAW with numerically exact chemical shieldings: The role of two-center contributions to the induced current von de Wijs, Gilles A., Kresse, Georg, Havenith, Remco W. A., Marsman, Martijn

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Exploring Multi-Anion Chemistry in Yttrium Oxyhydrides: Solid-State NMR Studies and DFT Calculations von Banerjee, Shrestha, Chaykina, Diana, Stigter, Rens, Colombi, Giorgio, Eijt, Stephan W. H., Dam, Bernard, de Wijs, Gilles A., Kentgens, Arno P. M.

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The Role of Connectivity on Electronic Properties of Lead Iodide Perovskite-Derived Compounds von Kamminga, Machteld E, de Wijs, Gilles A, Havenith, Remco W. A, Blake, Graeme R, Palstra, Thomas T.M

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Microscopic (Dis)order and Dynamics of Cations in Mixed FA/MA Lead Halide Perovskites von Grüninger, Helen, Bokdam, Menno, Leupold, Nico, Tinnemans, Paul, Moos, Ralf, De Wijs, Gilles A, Panzer, Fabian, Kentgens, Arno P. M

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Disorder to order: how halide mixing in MAPbI3−xBrx perovskites restricts MA dynamics von Fykouras, Kostas, Lahnsteiner, Jonathan, Leupold, Nico, Tinnemans, Paul, Moos, Ralf, Panzer, Fabian, de Wijs, Gilles A, Bokdam, Menno, Grüninger, Helen, Kentgens, Arno P M

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DFT Study of Planar Boron Sheets: A New Template for Hydrogen Storage von Er, Süleyman, de Wijs, Gilles A, Brocks, Geert

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Aliovalent Calcium Doping of Yttrium Oxyhydride Thin Films and Implications for Photochromism von Chaykina, Diana, Usman, Ismene, Colombi, Giorgio, Schreuders, Herman, Tyburska-Pueschel, Beata, Wu, Ziying, Eijt, Stephan W. H., Bannenberg, Lars J., de Wijs, Gilles A., Dam, Bernard

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Mixed Magnetism for Refrigeration and Energy Conversion von Dung, Nguyen H., Ou, Zhi Qiang, Caron, Luana, Zhang, Lian, Thanh, Dinh T. Cam, de Wijs, Gilles A., de Groot, Rob A., Buschow, K. H. Jürgen, Brück, Ekkes

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Preactive Site in Ziegler–Natta Catalysts von Blaakmeer, E. S. (Merijn), Wensink, Frank J, van Eck, Ernst R. H, de Wijs, Gilles A, Kentgens, Arno P. M

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Thermodynamic Stability of Boron:  The Role of Defects and Zero Point Motion von van Setten, Michiel J, Uijttewaal, Matthé A, de Wijs, Gilles A, de Groot, Robert A

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Symmetry, Dynamics, and Defects in Methylammonium Lead Halide Perovskites von Franssen, Wouter M. J, van Es, Sverre G. D, Dervişoğlu, Rıza, de Wijs, Gilles A, Kentgens, Arno P. M

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Improved hydrogen storage in Ca-decorated boron heterofullerenes: a theoretical study von Er, Süleyman, de Wijs, Gilles A, Brocks, Geert

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Correction to “Aliovalent Calcium Doping of Yttrium Oxyhydride Thin Films and Implications for Photochromism” von Chaykina, Diana, Usman, Ismene, Colombi, Giorgio, Schreuders, Herman, Tyburska-Pueschel, Beata, Wu, Ziying, Eijt, Stephan W. H., Bannenberg, Lars J., de Wijs, Gilles A., Dam, Bernard

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Disorder to order: how halide mixing in MAPbI 3- x Br x perovskites restricts MA dynamics von Fykouras, Kostas, Lahnsteiner, Jonathan, Leupold, Nico, Tinnemans, Paul, Moos, Ralf, Panzer, Fabian, de Wijs, Gilles A, Bokdam, Menno, Grüninger, Helen, Kentgens, Arno P M

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Carbon Support Effects on the Hydrogen Storage Properties of LiBH4 Nanoparticles: A First-Principles Study von Hazrati, Ebrahim, Brocks, Geert, de Wijs, Gilles A

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First-Principles Study of LiBH4 Nanoclusters and Their Hydrogen Storage Properties von Hazrati, Ebrahim, Brocks, Geert, de Wijs, Gilles A

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Phonons and electron-phonon coupling in graphene-h-BN heterostructures von Slotman, Guus J., de Wijs, Gilles A., Fasolino, Annalisa, Katsnelson, Mikhail I.

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Interfacial charge transfer and Schottky barriers at c-Si/a-In heterojunctions von Fang, Piet Xiaowen, Nihtianov, Stoyan, Sberna, Paolo, de Wijs, Gilles A, Fang, Changming

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Structural Studies of Polyaramid Fibers: Solid-State NMR and First-Principles Modeling von Brauckmann, J. Ole, Zolfaghari, Pegah, Verhoef, René, Klop, Enno A, de Wijs, Gilles A, Kentgens, Arno P. M

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Hydrogen Storage by Polylithiated Molecules and Nanostructures von Er, Süleyman, de Wijs, Gilles A, Brocks, Geert

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