Spatial decomposition and assignment of infrared spectra of simple ions in water from mid-infrared to THz frequencies: Li(+)(aq) and F(-)(aq) by Smiechowski, Maciej, Forbert, Harald, Marx, Dominik

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Improving the Yield and Rate of Acid‐Catalyzed Deconstruction of Lignin by Mechanochemical Activation by Patel, Darpan H., Marx, Dominik, East, Allan. L. L.

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Disfavoring Mechanochemical Reactions by Stress-Induced Steric Hindrance by Krupička, Martin, Marx, Dominik

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Covalent Mechanochemistry: Theoretical Concepts and Computational Tools with Applications to Molecular Nanomechanics by Ribas-Arino, Jordi, Marx, Dominik

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Quantum corrections to classical time-correlation functions: hydrogen bonding and anharmonic floppy modes by Ramírez, Rafael, López-Ciudad, Telesforo, Kumar P, Padma, Marx, Dominik

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Reactive path integral quantum simulations of molecules solvated in superfluid helium by Walewski, Łukasz, Forbert, Harald, Marx, Dominik

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Methanol synthesis on ZnO(0001). I. Hydrogen coverage, charge state of oxygen vacancies, and chemical reactivity by Kiss, Janos, Witt, Alexander, Meyer, Bernd, Marx, Dominik

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Comment on “Inter/Intramolecular Bonds in TH5 + (T = C/Si/Ge): H2 as Tetrel Bond Acceptor and the Uniqueness of Carbon Bonds” by Marx, Dominik

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Comment on “Inter/Intramolecular Bonds in TH 5 + (T = C/Si/Ge): H 2 as Tetrel Bond Acceptor and the Uniqueness of Carbon Bonds” by Marx, Dominik

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Methanol synthesis on ZnO(0001). II. Structure, energetics, and vibrational signature of reaction intermediates by Kiss, Janos, Frenzel, Johannes, Meyer, Bernd, Marx, Dominik

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Communications: On artificial frequency shifts in infrared spectra obtained from centroid molecular dynamics: Quantum liquid water by Ivanov, Sergei D, Witt, Alexander, Shiga, Motoyuki, Marx, Dominik

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Adaptive Switching of Interaction Potentials in the Time Domain: An Extended Lagrangian Approach Tailored to Transmute Force Field to QM/MM Simulations and Back by Böckmann, Marcus, Doltsinis, Nikos L, Marx, Dominik

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Quantum Effects on Vibrational and Electronic Spectra of Hydrazine Studied by “On-the-Fly” ab Initio Ring Polymer Molecular Dynamics by Kaczmarek, Anna, Shiga, Motoyuki, Marx, Dominik

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Cu/ZnO nanocatalysts in response to environmental conditions: surface morphology, electronic structure, redox state and CO2 activation by Martínez-Suárez, Luis, Frenzel, Johannes, Marx, Dominik

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Glycine at the Pyrite−Water Interface:  The Role of Surface Defects by Nair, Nisanth N, Schreiner, Eduard, Marx, Dominik

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Understanding the infrared spectrum of bare CH5 by ASVANY, Oskar, KUMAR P, Padma, REDLICH, Britta, HEGEMANN, Ilka, SCHLEMMER, Stephan, MARX, Dominik

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The nature of the hydrated excess proton in water by Marx, Dominik, Tuckerman, Mark E, Hutter, Jürg, Parrinello, Michele

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Partial Dissociation of Water Leads to Stable Superstructures on the Surface of Zinc Oxide by Meyer, Bernd, Marx, Dominik, Dulub, Olga, Diebold, Ulrike, Kunat, Martin, Langenberg, Deler, Wöll, Christof

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The effect of tensile stress on the conformational free energy landscape of disulfide bonds by Anjukandi, Padmesh, Dopieralski, Przemyslaw, Ribas-Arino, Jordi, Marx, Dominik

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Aggregation-Induced Chemical Reactions: Acid Dissociation in Growing Water Clusters by Forbert, Harald, Masia, Marco, Kaczmarek-Kedziera, Anna, Nair, Nisanth N, Marx, Dominik

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