Not logged inCP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculations
Kuehne, Thomas D.; Iannuzzi, Marcella; Del Ben, Mauro; Rybkin, Vladimir V.; Seewald, Patrick; Stein, Frederick; Laino, Teodoro; Khaliullin, Rustam Z.; Schutt, Ole; Schiffmann, Florian; Golze, Dorothea; Wilhelm, Jan; Chulkov, Sergey; Bani-Hashemian, Mohammad Hossein; Weber, Valery; Borstnik, Urban; Taillefumier, Mathieu; Jakobovits, Alice Shoshana; Lazzaro, Alfio; Pabst, Hans; Mueller, Tiziano; Schade, Robert; Guidon, Manuel; Andermatt, Samuel; Holmberg, Nico; Schenter, Gregory K.; Hehn, Anna; Bussy, Augustin; Belleflamme, Fabian; Tabacchi, Gloria; Gloss, Andreas; Lass, Michael; Bethune, Iain; Mundy, Christopher J.; Plessl, Christian; Watkins, Matt; VandeVondele, Joost; Krack, Matthias; Hutter, Jurg .png)
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SaveShare Save Decisive Role of Perimeter Sites in Silica-Supported Ag Nanoparticles in Selective Hydrogenation of CO2 to Methyl Formate in the Presence of MethanolCorral-Perez, Juan Jose; Bansode, Atul; Praveen, C. S.; Kokalj, Anton; Reymond, Helena; Comas-Vives, Aleix; VandeVondele, Joost; Coperet, Christophe; von Rohr, Philipp Rudolf; Urakawa, Atsushi Share Save Share Save Share Save Share Save Share Save Share Save Share Save Share Save Share Save Share Save Share Save Molecular Ordering at the Interface Between Liquid Water and Rutile TiO2(110)Serrano, Giulia; Bonanni, Beatrice; Di Giovannantonio, Marco; Kosmala, Tomasz; Schmid, Michael; Diebold, Ulrike; Di Carlo, Aldo; Cheng, Jun; VandeVondele, Joost; Wandelt, Klaus; Goletti, Claudio Share Save Share Save Share Save Share Save Share Save Share Save Share Save 
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