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Physical Review Letters|April 8, 2011
Unraveling the stability of polypeptide helices: critical role of van der Waals interactionsAlexandre Tkatchenko, Mariana Rossi, Volker Blum, et al.Physical Review Letters|March 5, 2009
Defect formation energies without the band-gap problem: combining density-functional theory and the GW approach for the silicon self-interstitialPatrick Rinke, Anderson Janotti, Matthias Scheffler, et al.Angewandte Chemie (International Ed. in English)|October 1, 2011
CO oxidation as a prototypical reaction for heterogeneous processesHans-Joachim Freund, Gerard Meijer, Matthias Scheffler, et al.Physical Review Letters|May 1, 2012
Density-functional theory with screened van der Waals interactions for the modeling of hybrid inorganic-organic systemsVictor G Ruiz, Wei Liu, Egbert Zojer, et al.Clinical Pharmacokinetics|May 11, 2011
Clinical pharmacokinetics of tyrosine kinase inhibitors: focus on 4-anilinoquinazolinesMatthias Scheffler, Paola Di Gion, Oxana Doroshyenko, et al.Physical Review Letters|January 17, 2012
Van der Waals interactions in ionic and semiconductor solidsGuo-Xu Zhang, Alexandre Tkatchenko, Joachim Paier, et al.Physical Review Letters|June 24, 2017
Formation of Vacancies in Si- and Ge-based Clathrates: Role of Electron Localization and Symmetry BreakingAmrita Bhattacharya, Christian Carbogno, Bodo Böhme, et al.Physical Review Letters|August 13, 2013
Concentration of vacancies at metal-oxide surfaces: case study of MgO(100)Norina A Richter, Sabrina Sicolo, Sergey V Levchenko, et al.Journal of the American Chemical Society|October 28, 2017
Contrasting the Role of Ni/Al2O3 Interfaces in Water-Gas Shift and Dry Reforming of MethaneLucas Foppa, Tigran Margossian, Sung Min Kim, et al.Physical Review Letters|January 15, 2011
Magnetism in C- or N-doped MgO and ZnO: a density-functional study of impurity pairsHua Wu, Alessandro Stroppa, Sung Sakong, et al.Pageof 20