Zeitschriftenartikel (8218)

1801.
Zeitschriftenartikel
Seshaditya, .; Ghiringhelli, L. M.; Delle Site, L.: Levy-Lieb-Based Monte Carlo Study of the Dimensionality Behaviour of the Electronic Kinetic Functional. Computation 5 (2), 30 (2017)
1802.
Zeitschriftenartikel
Shang, H.; Carbogno, C.; Rinke, P.; Scheffler, M.: Lattice dynamics calculations based on density-functional perturbation theory in real space. Computer Physics Communications 215, S. 26 - 46 (2017)
1803.
Zeitschriftenartikel
Shtukenberg, A. G.; Zhu, Q.; Carter, D. J.; Vogt, L.; Hoja, J.; Schneider, E.; Song, H.; Pokroy, B.; Polishchuk, I.; Tkatchenko, A. et al.; Oganov, A. R.; Rohl, A. L.; Tuckerman, M. E.; Kahr, B.: Powder diffraction and crystal structure prediction identify four new coumarin polymorphs. Chemical Science 8 (7), S. 4926 - 4940 (2017)
1804.
Zeitschriftenartikel
Simoes Brambila, D.; Harvey, A. G.; Houfek, K.; Mašín, Z.; Smirnova, O.: Role of electronic correlations in photoionization of NO2 in the vicinity of the 2A1/2B2 conical intersection. Physical Chemistry Chemical Physics 19 (30), S. 19673 - 19682 (2017)
1805.
Zeitschriftenartikel
Sinstein, M.; Scheurer, C.; Matera, S.; Blum, V.; Reuter, K.; Oberhofer, H.: Efficient Implicit Solvation Method for Full Potential DFT. Journal of Chemical Theory and Computation 13 (11), S. 5582 - 5603 (2017)
1806.
Zeitschriftenartikel
Solis, B. H.; Cui, Y.; Weng, X.; Seifert, J.; Schauermann, S.; Sauer, J.; Shaikhutdinov, S. K.; Freund, H.-J.: Initial stages of CO2 adsorption on CaO: a combined experimental and computational study. Physical Chemistry Chemical Physics 19 (6), S. 4231 - 4242 (2017)
1807.
Zeitschriftenartikel
Solis, B. H.; Sauer, J.; Shaikhutdinov, S. K.; Freund, H.-J.: Oxygen Scrambling of CO2 Adsorbed on CaO(001). The Journal of Physical Chemistry C 121, S. 18625 - 18634 (2017)
1808.
Zeitschriftenartikel
Song, X.; Fagiani, M. R.; Debnath, S.; Gao, M.; Maeda, S.; Taketsugu, T.; Gewinner, S.; Schöllkopf, W.; Asmis, K. R.; Lyalin, A.: Excess charge driven dissociative hydrogen adsorption on Ti2O4. Physical Chemistry Chemical Physics 19 (17), S. 23154 - 23161 (2017)
1809.
Zeitschriftenartikel
Song, X.; Fagiani, M. R.; Gewinner, S.; Schöllkopf, W.; Asmis, K. R.; Bischoff, F. A.; Berger, F.; Sauer, J.: Gas-Phase Vibrational Spectroscopy of the Aluminum Oxide Anions (Al2O3)1-6AlO2-. ChemPhysChem 18 (8), S. 868 - 872 (2017)
1810.
Zeitschriftenartikel
Song, X.; Fagiani, M. R.; Gewinner, S.; Schöllkopf, W.; Asmis, K. R.; Bischoff, F. A.; Berger, F.; Sauer, J.: Inside Cover: Gas-Phase Vibrational Spectroscopy of the Aluminum Oxide Anions (Al2O3)1-6AlO2-. ChemPhysChem 18 (8), S. 866 - 866 (2017)
1811.
Zeitschriftenartikel
Stähler, J.; Rinke, P.: Global and local aspects of the surface potential landscape for energy level alignment at organic-ZnO interfaces. Chemical Physics 485-486, S. 149 - 165 (2017)
1812.
Zeitschriftenartikel
Staub, U.; Rettig, L.; Bothschafter, E. M.; Windsor, Y. W.; Ramakrishnan, M.; Avula, S. R. V.; Dreiser, J.; Piamonteze, C.; Scagnoli, V.; Mukherjee, S. et al.; Niedermayer, C.; Medarde, M.; Pomjakushina, E.: Interplay of Fe and Tm moments through the spin-reorientation transition in TmFe O3. Physical Review B 96 (17), 174408 (2017)
1813.
Zeitschriftenartikel
Stegmaier, S.; Voss, J.; Reuter, K.; Luntz, A. C.: Li+ Defects in a Solid-State Li Ion Battery: Theoretical Insights with a Li3OCl Electrolyte. Chemistry of Materials 29 (10), S. 4330 - 4340 (2017)
1814.
Zeitschriftenartikel
Su, D. S.; Wen, G.; Wu, S.; Peng, F.; Schlögl, R.: Carbocatalysis in Liquid-Phase Reactions. Angewandte Chemie International Edition 56 (4), S. 936 - 964 (2017)
1815.
Zeitschriftenartikel
Su, D. S.; Wen, G.; Wu, S.; Peng, F.; Schlögl, R.: Carbokatalyse in Flüssigphasenreaktionen. Angewandte Chemie 129 (4), S. 956 - 985 (2017)
1816.
Zeitschriftenartikel
Sun, J.; Xu, J.; Grafmueller, A.; Huang, X.; Liedel, C.; Algara-Siller, G.; Willinger, M. G.; Yang, C.; Fu, Y.; Wang, X. et al.; Shalom, M.: Self-assembled carbon nitride for photocatalytic hydrogen evolution and degradation of p-nitrophenol. Applied Catalysis B 205, S. 1 - 10 (2017)
1817.
Zeitschriftenartikel
Supady, A.; Hecht, S.; Baldauf, C.: About Underappreciated Yet Active Conformations of Thiourea Organocatalysts. Organic Letters 19 (16), S. 4199 - 4202 (2017)
1818.
Zeitschriftenartikel
Sutton, C. A.; Tummala, N. R.; Beljonne, D.; Brédas, J.-L.: Singlet Fission in Rubrene Derivatives: Impact of Molecular Packing. Chemistry of Materials 29 (7), S. 2777 - 2787 (2017)
1819.
Zeitschriftenartikel
Thomas, J.; Thomas, N.; Girgsdies, F.; Behrens, M.; Huang, X.; Sudheesh, V. D.; Sebastian, V.: Synthesis of cobalt ferrite nanoparticles by constant pH co-precipitation and their high catalytic activity in CO oxidation. New Journal of Chemistry 41 (15), S. 7356 - 7363 (2017)
1820.
Zeitschriftenartikel
Tinti, G.; Marchetto, H.; Vaz, C. A. F.; Kleibert, A.; Andrä, M.; Barten, R.; Bergamaschi, A.; Brückner, M.; Cartier, S.; Dinapoli, R. et al.; Franz, T.; Fröjdh, E.; Greiffenberg, D.; Lopez-Cuenca, C.; Mezza, D.; Mozzanica, A.; Nolting, F.; Ramilli, M.; Redford, S.; Ruat, M.; Ruder, C.; Schädler, L.; Schmidt, T.; Schmitt, B.; Schütz, F.; Shi, X.; Thattil, D.; Vetter, S.; Zhang, J.: The EIGER detector for low-energy electron microscopy and photoemission electron microscopy. Journal of Synchrotron Radiation 24 (5), S. 963 - 974 (2017)
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