Aquilante, F.; Autschbach, J.; Carlson, R.; Chibotaru, L.; Delcey, M.; De Vico, L.; Galvan, I.; Ferre, N.; Frutos, L.; Gagliardi, L. et al.; Garavelli, M.; Giussani, A.; Hoyer, C.; Li Manni, G.; Lischka, H.; Ma, D.; Malmqvist, P.; Muller, T.; Nenov, A.; Olivucci, M.; Pedersen, T.; Peng, D.; Plasser, F.; Pritchard, B.; Reiher, M.; Rivalta, I.; Schapiro, I.; Segarra-Marti, J.; Stenrup, M.; Truhlar, D.; Ungur, L.; Valentini, A.; Vancoillie, S.; Veryazov, V.; Vysotskiy, V.; Weingart, O.; Zapata, F.; Lindh, R.: Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table. Journal of Computational Chemistry 37 (5), pp. 506 - 541 (2016)

Arora, N.; Dar, M.; Abdi-Jalebi, M.; Giordano, F.; Pellet, N.; Jacopin, G.; Friend, R.; Zakeeruddin, S.; Gräzel, M.: Intrinsic and Extrinsic Stability of Formamidinium Lead Bromide Perovskite Solar Cells Yielding High Photovoltage. Nano Letters 16 (11), pp. 7155 - 7162 (2016)

Arrigoni, M.; Bjørheim, T.; Kotomin, E.; Maier, J.: First principles study of confinement effects for oxygen vacancies in BaZrO₃(001) ultra-thin films. Physical Chemistry Chemical Physics 18 (15), pp. 9902 - 9908 (2016)

Ast, C.; Jäck, B.; Senkpiel, J.; Eltschka, M.; Etzkorn, M.; Ankerhold, J.; Kern, K.: Sensing the quantum limit in scanning tunnelling spectroscopy. Nature Communications 7, 13009 (2016)

Audehm, P.; Schmidt, M.; Brück, S.; Tietze, T.; Grafe, J.; Macke, S.; Schutz, G.; Goering, E.: Pinned orbital moments - A new contribution to magnetic anisotropy. Scientific Reports 6, 25517 (2016)

Babizhetskyy, V.; Myakush, O.; Levytskyy, V.; Köhler, J.; Simon, A.; Michor, H.; Kotur, B.: Homogeneity ranges and physical properties of ternary Laves phases R_xZr_1-xNi₂ (R = Gd-Lu). Journal of Alloys and Compounds 661, pp. 490 - 494 (2016)

Baiutti, F.; Gregori, G.; Wang, Y.; Suyolcu, Y.; Cristiani, G.; van Aken, P.; Maier, J.; Logvenov, G.: Cationic Redistribution at Epitaxial Interfaces in Superconducting Two-Dimensionally Doped Lanthanum Cuprate Films. ACS Applied Materials & Interfaces 8 (40), pp. 27368 - 27375 (2016)

Baumann, V.; Röttgermann, P.; Haase, F.; Szendrei, K.; Dey, P.; Lyons, K.; Wyrwich, R.; Gräßel, M.; Stehr, J.; Ullerich, L. et al.; Bürsgens, F.; Rodríguez-Fernández, J.: Highly stable and biocompatible gold nanorod-DNA conjugates as NIR probes for ultrafast sequence-selective DNA melting. RCS Advances 6 (105), pp. 103724 - 103739 (2016)

Benia, H.; Rampi, E.; Trainer, C.; Yim, C.; Maldonado, A.; Peets, D.; Stöhr, A.; Starke, U.; Kern, K.; Yaresko, A. et al.; Levy, G.; Damascelli, A.; Ast, C.; Schnyder, A.; Wahl, P.: Observation of Dirac surface states in the noncentrosymmetric superconductor BiPd. Physical Review B 94 (12), 121407 (2016)

Benitez, F.; Duclut, C.; Chate, H.; Delamotte, B.; Dornic, I.; Muñoz, M.: Langevin Equations for Reaction-Diffusion Processes. Physical Review Letters 117 (10), 100601 (2016)

Bern, F.; Ziese, M.; Vrejoiu, I.; Li, X.; van Aken, P. A.: Magnetic and magnetotransport properties of ultrathin La_0.7Ba_0.3MnO₃ epitaxial films embedded in SrRuO₃. New Journal of Physics 18, 053021 (2016)

Bette, S.; Dinnebier, R. E.; Kremer, R. K.; Freyer, D.: Ni₃Cl_2+x(OH)_4-x•2H₂O: Structural, Thermal, Spectral, and Magnetic Properties in Dependence of the Chloride Content. European Journal of Inorganic Chemistry 2016 (12), pp. 1875 - 1885 (2016)

Bette, S.; Rincke, C.; Dinnebier, R. E.; Voigt, W.: Crystal Structure and Hydrate Water Content of Synthetic Hellyerite, NiCO₃•5.5H₂O. Zeitschrift für anorganische und allgemeine Chemie 642 (9-10), pp. 652 - 659 (2016)

Betzler, S.; Podjaski, F.; Beetz, M.; Handloser, K.; Wisnet, A.; Handloser, M.; Hartschuh, A.; Lotsch, B. V.; Scheu, C.: Titanium Doping and Its Effect on the Morphology of Three Dimensional Hierarchical Nb₃O₇(OH) Nanostructures for Enhanced Light-Induced Water Splitting. Chemistry of Materials 28 (21), pp. 7666 - 7672 (2016)

Bieniasz, K.; Berciu, M.; Daghofer, M.; Oleś, A.: Green's function variational approach to orbital polarons in KCuF₃. Physical Review B 94 (8), 085117 (2016)

Bieniasz, K.; Berciu, M.; Oleś, A.: The Green Function Variational Approximation: Significance of Physical Constraints. Acta Physica Polonica A 130 (2), pp. 659 - 662 (2016)

Bisoyi, S.; Rödel, R.; Zschieschang, U.; Kang, M.; Takimiya, K.; Klauk, H.; Tiwari, S.: A comprehensive study of charge trapping in organic field-effect devices with promising semiconductors and different contact metals by displacement current measurements. Semiconductor Science and Technology 31 (2), 025011 (2016)

Bjorkrnan, T.; Skakalova, V.; Kurasch, S.; Kaiser, U.; Meyer, J.; Smet, J.; Krasheninnikov, A.: Vibrational Properties of a Two-Dimensional Silica Kagome Lattice. ACS Nano 10 (12), pp. 10929 - 10935 (2016)

Bjørheim, T. S.; Arrigoni, M.; Saeed, S. W.; Kotomin, E.; Maier, J.: Surface Segregation Entropy of Protons and Oxygen Vacancies in BaZrO₃. Chemistry of Materials 28, pp. 1363 - 1368 (2016)

Booth, G.; Tsatsoulis, T.; Chan, G.; Grüneis, A.: From plane waves to local Gaussians for the simulation of correlated periodic systems. The Journal of Chemical Physics 145 (8), 084111 (2016)