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Daldrop, J. O.; Saita, M.; Heyden, M.; Lorenz-Fonfria, V. A.; Heberle, J.; Netz, R. R. Orientation of non-Spherical Protonated Water Clusters Revealed by Infrared Absorption Dichroism. Nature Communications 2018, 9, 311.

de Souza, B.; Neese, F.; Izsák, R. On the Theoretical Prediction of Fluorescence Rates from First Principles Using the Path Integral Approach. The Journal of Chemical Physics 2018, 148, 034104.

Pinski, P.; Neese, F. Communication: Exact Analytical Derivatives for the Domain-Based Local Pair Natural Orbital MP2 Method (DLPNO-MP2). The Journal of Chemical Physics 2018, 148, 031101.

Wang, Q.-N.; Shi, L.; Li , W.; Li, W.-C.; Si, R.; Schüth, F.; Lu, A.-H. Cu Supported on Thin Carbon Layer-Coated Porous SiO₂ for Efficient Ethanol Dehydrogenation. Catalysis Science & Technology 2018, 8, 472–479.

Dirkmann, M.; Iglesias-Fernandez, J.; Muñoz, V.; Sokkar, P.; Rumancev, C.; von Gundlach, A.; Krenczyk, O.; Vöpel, T.; Nowack, J.; Schroer, M. A.; Ebbinghaus, S.; Herrmann, C.; Rosenhahn, A.; Sanchez-Garcia, E.; Schulz, F. A Multiperspective Approach to Solvent Regulation of Enzymatic Activity: HMG‐CoA Reductase. Chembiochem 2018, 19, 153–158.

Krämer, R.; Nöthling, N.; Lehmann, C. W.; Mohr, F.; Tausch, M. W. E-Diazocine in Chemical Education: Synthesis, Structure, Photochromism and Thermal Stability. ChemPhotoChem 2018, 2, 6–11.

Fritsch, N.; Wick, C. R.; Waidmann, T.; Pflock, S.; Dral, P. O.; Tucher, J.; Steiner, C.; Shubina, T. E.; Maier, S.; Clark, T.; Burzlaff, N. 1D Chains of Diruthenium Tetracarbonyl Sawhorse Complexes. European Journal of Inorganic Chemistry 2018, 2018, 54–61.

Monguzzi, A.; Ballabio, M.; Yanai, N.; Kimizuka, N.; Fazzi, D.; Campione, M.; Meinardi, F. Highly Fluorescent Metal–Organic-Framework Nanocomposites for Photonic Applications. Nano Letters 2018, 18, 528–534.

Rumpel, S.; Ravera, E.; Sommer, C.; Reijerse, E.; Farès, C.; Luchinat, C.; Lubitz, W. ¹H NMR Spectroscopy of [FeFe] Hydrogenase: Insight into the Electronic Structure of the Active Site. Journal of the American Chemical Society 2018, 140, 131–134.

Sun, Z.; Wu, L.; Bocola, M.; Chan, H. C. S.; Lonsdale, R.; Kong, X.-D.; Yuan, S.; Zhou, J.; Reetz, M. T. Structural and Computational Insight into the Catalytic Mechanism of Limonene Epoxide Hydrolase Mutants in Stereoselective Transformations. Journal of the American Chemical Society 2018, 140, 310–318.

Dutta, A. K.; Nooijen, M.; Neese, F.; Izsák, R. Exploring the Accuracy of a Low Scaling Similarity Transformed Equation of Motion Method for Vertical Excitation Energies. Journal of Chemical Theory and Computation 2018, 14, 72–91.

Roemelt, M.; Krewald, V.; Pantazis, D. A. Exchange Coupling Interactions from the Density Matrix Renormalization Group and N-Electron Valence Perturbation Theory: Application to a Biomimetic Mixed-Valence Manganese Complex. Journal of Chemical Theory and Computation 2018, 14, 166–179.

Gottschalk, H. C.; Poblotzki, A.; Suhm, M. A.; Al-Mogren, M. M.; Antony, J.; Auer, A. A.; Baptista, L.; Benoit, D. M.; Bistoni, G.; Bohle, F.; Dahmani, R.; Firaha, D.; Grimme, S.; Hansen, A.; Harding, M. E.; Hochlaf, M.; Holzner, C.; Jansen, G.; Klopper, W.; Kopp, W. A.; Kröger, L. C.; Leonhard, K.; Mouhib, H.; Neese, F.; Pereira, M. N.; Ulusoy, I. S.; Wuttke, A.; Mata, R. A. The Furan Microsolvation Blind Challenge for Quantum Chemical Methods: First Steps. The Journal of Chemical Physics 2018, 148, 014301.

Guo, Y.; Riplinger, C.; Becker, U.; Liakos, D. G.; Minenkov, Y.; Cavallo, L.; Neese, F. Communication: An Improved Linear Scaling Perturbative Triples Correction for the Domain Based Local Pair-Natural Orbital Based Singles and Doubles Coupled Cluster Method [DLPNO-CCSD(T)]. The Journal of Chemical Physics 2018, 148, 011101.

Kwon, Y.; Schulthoff, S.; Dao, Q. M.; Wirtz, C.; Fürstner, A. Total Synthesis of Disciformycin A and B: Unusually Exigent Targets of Biological Significance. Chemistry – A European Journal 2018, 24, 109–114.

Neese, F. Software Update: the ORCA Program System, Version 4.0. Wiley Interdisciplinary Reviews: Computational Molecular Science 2018, 8, e1327.

Acevedo-Rocha, C. G.; Ferla, M.; Reetz, M. T. Directed Evolution of Proteins Based on Mutational Scanning; Bornscheuer, U. T., Höhne, M., Eds.; Bornscheuer, U. T., Höhne, M., Series Eds.; Methods in Molecular Biology; Springer: New York, 2018; Vol. 1685, pp 87–128.

Abdellatif, S.; Josten, S.; Sharifi, P.; Kirah, K.; Ghannam, R.; Khalil, A. S. G.; Erni, D.; Marlow, F. Optical Investigation of Porous TiO₂ in Mesostructured Solar Cells. In Proceedings SPIE 10526, Physics and Simulation of Optoelectronic Devices XXVI; 2018.

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