%D9%8A%D9%88%D8%A7%D8%AE%D9%8A%D9%85_%D8%B2%D8%A7%D9%88%D8%B1%DB%8C%D9%88%D8%A7%D8%AE%DB%8C%D9%85_%D8%B2%D8%A7%D9%88%D8%B1Category:Joachim_SauerJoachim_SauerJoachim_SauerJoachim_SauerJoachim_Sauer%DB%8C%D9%88%D8%A7%D8%AE%DB%8C%D9%85_%D8%B2%D8%A7%D9%88%D8%B1Joachim_Sauer%D7%99%D7%95%D7%90%D7%9B%D7%99%D7%9D_%D7%96%D7%90%D7%95%D7%90%D7%A8Joachim_Sauer%E3%83%A8%E3%82%A2%E3%83%92%E3%83%A0%E3%83%BB%E3%82%B6%E3%82%A6%E3%82%A2%E3%83%BC%EC%9A%94%EC%95%84%ED%9E%98_%EC%9E%90%EC%9A%B0%EC%96%B4Joachim_SauerJoachim_SauerJoachim_SauerJoachim_SauerJoachim_SauerJoachim_Sauer%D0%97%D0%B0%D1%83%D1%8D%D1%80,_%D0%98%D0%BE%D0%B0%D1%85%D0%B8%D0%BCJoachim_SauerJoachim_SauerJoachim_SauerJoachim_Sauer%D0%99%D0%BE%D0%B0%D1%85%D1%96%D0%BC_%D0%97%D0%B0%D1%83%D0%B5%D1%80Q62085%E7%BA%A6%E9%98%BF%E5%B8%8C%E5%A7%86%C2%B7%E7%BB%8D%E5%B0%94
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Ab Initio Calculation of Rate Constants for Molecule-Surface Reactions with Chemical AccuracyVibrational properties of surface hydroxyls: Nonempirical model calculations including anharmonicitiesGas-phase infrared photodissociation spectroscopy of tetravanadiumoxo and oxo-methoxo cluster anions.Pyrazolate-based cobalt(II)-containing metal-organic frameworks in heterogeneous catalytic oxidation reactions: elucidating the role of entatic states for biomimetic oxidation processes.Quantum Chemical Free Energies: Structure Optimization and Vibrational Frequencies in Normal Modes.Effect of Anharmonicity on Adsorption Thermodynamics.Oxidative dehydrogenation of hydrocarbons by V3O7(+) compared to other vanadium oxide species.Quantum chemical modeling of benzene ethylation over H-ZSM-5 approaching chemical accuracy: a hybrid MP2:DFT study.The tert-butyl cation in H-zeolites: deprotonation to isobutene and conversion into surface alkoxides.Preferential activation of primary C-H bonds in the reactions of small alkanes with the diatomic MgO(+*) cation.Activation of C-H bonds mediated by Mo[triple bond]Mo moieties in heterobimetallic Zn/O/Mo clusters.Stability and migration barriers of small vanadium oxide clusters on the CeO2(111) surface studied by density functional theory.Stable mechanistically-relevant aromatic-based carbenium ions in zeolite catalysts.Modeling environmental effects on charge density distributions in polar organometallics: validation of embedded cluster models for the methyl lithium crystal.Computational elucidation of the transition state shape selectivity phenomenon.Water on the MgO(001) Surface: Surface Reconstruction and Ion Solvation.Atomic structure of an ultrathin Fe-silicate film grown on a metal: a monolayer of clay?Quantum chemical modeling of zeolite-catalyzed methylation reactions: toward chemical accuracy for barriers.Cooperative formation of long-range ordering in water ad-layers on Fe3O4(111).Toward an Understanding of Selective Alkyne Hydrogenation on Ceria: On the Impact of O Vacancies on H2 Interaction with CeO2(111).O2 Activation on Ceria Catalysts-The Importance of Substrate Crystallographic Orientation.Initial stages of CO2 adsorption on CaO: a combined experimental and computational study.Application of semiempirical long-range dispersion corrections to periodic systems in density functional theory.Protonated isobutene in zeolites: tert-butyl cation or alkoxide?V2O5/SiO2 surface inspired, silsesquioxane-derived oxovanadium complexes and their properties.Oxidative activation of n-butane on sulfated zirconia.Size-dependent catalytic activity of supported vanadium oxide species: oxidative dehydrogenation of propane.Adsorption, activation, and dissociation of oxygen on doped oxides.Polyhedral vanadium oxide cages: infrared spectra of cluster anions and size-induced d electron localization.Hydrogen adsorbed in a metal organic framework-5: coupled translation-rotation eigenstates from quantum five-dimensional calculations.Chemically accurate adsorption energies for methane and ethane monolayers on the MgO(001) surface.Dissociative Water Adsorption by Al3O4+ in the Gas Phase.Surface Termination of Fe3O4(111) Films Studied by CO Adsorption Revisited.Water adsorption and O-defect formation on Fe2O3(0001) surfaces.Ab Initio Prediction of Adsorption Isotherms for Gas Mixtures by Grand Canonical Monte Carlo Simulations on a Lattice of Sites.Quantum chemical ab initio prediction of proton exchange barriers between CH4 and different H-zeolites.Environmental effects on vibrational proton dynamics in H5O2+: DFT study on crystalline H5O2+ClO4-.Accurate adsorption energies of small molecules on oxide surfaces: CO-MgO(001).Identification of conical structures in small aluminum oxide clusters: infrared spectroscopy of (Al2O3)1-4(AlO)+.Structure and properties of bimetallic titanium and vanadium oxide clusters.
P50
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P50
description
Angela Merkel'in Eşi
@tr
Duits scheikundige
@nl
German chemist
@en
German chemist
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German chemist
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Saksamaa keemik
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ceimiceoir Gearmánach
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chimico tedesco
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chimist german
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chimiste allemand
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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altLabel
J. Sauer
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Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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Joachim Sauer
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P166
P463
P214
P227
P269
P646
P8172
P1284
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