Joachim Sauer (J Sauer)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 34

Top Topics

Carbon Nanotubes

Molecular Dynamics

Staphylococcus Aureus

Density Functional Theory

Top Venues

Journal of the American Chemical Society

Journal of chemical theory and computation

Angewandte Chemie (International ed. in English)

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Christopher Sheldon, Joachim Paier, Denis Usvyat, Joachim Sauer
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111). Journal of chemical theory and computation 20 (5) (2024)
Henning Windeck, Fabian Berger, Joachim Sauer
Chemically accurate predictions for water adsorption on Brønsted sites of zeolite H-MFI. Physical chemistry chemical physics : PCCP (2024)
Christopher Sheldon, Joachim Paier, Denis Usvyat, Joachim Sauer
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111). Journal of chemical theory and computation 20 (5) (2024)
Christopher Sheldon, Joachim Paier, Denis Usvyat, Joachim Sauer
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111). Journal of chemical theory and computation (2024)
Christopher Sheldon, Joachim Paier, Denis Usvyat, Joachim Sauer
Hybrid RPA:DFT Approach for Adsorption on Transition Metal Surfaces: Methane and Ethane on Platinum (111). Journal of chemical theory and computation 20 (5) (2024)
Henning Windeck, Fabian Berger, Joachim Sauer
Spectroscopic Signatures of Internal Hydrogen Bonds of Brønsted-Acid Sites in the Zeolite H-MFI. Angewandte Chemie (International ed. in English) (2023)
Nikita Hanikel, Daria Kurandina, Saumil Chheda, Zhiling Zheng, Zichao Rong, S Ephraim Neumann, Joachim Sauer, J Ilja Siepmann, Soumen Ghosh, Omar M Yaghi
MOF Linker Extension Strategy for Enhanced Atmospheric Water Harvesting. ACS central science 9 (3) (2023)
Nikita Hanikel, Daria Kurandina, Saumil Chheda, Zhiling Zheng, Zichao Rong, S Ephraim Neumann, Joachim Sauer, J Ilja Siepmann, Soumen Ghosh, Omar M Yaghi
MOF Linker Extension Strategy for Enhanced Atmospheric Water Harvesting. ACS central science 9 (3) (2023)
Marcin Rybicki, Joachim Sauer
Rigid Body Approximation for the Anharmonic Description of Molecule-Surface Vibrations. Journal of chemical theory and computation 18 (9) (2022)
Ya-Ke Li, Fabian Müller, Wieland Schöllkopf, Knut R Asmis, Joachim Sauer
Gas-Phase Mechanism of O .- /Ni 2+ -Mediated Methane Conversion to Formaldehyde. Angewandte Chemie (International ed. in English) 61 (29) (2022)
Marcin Rybicki, Kaido Sillar, Joachim Sauer
Dual-Site Model for Ab Initio Calculations of Gibbs Free Energies and Enthalpies of Adsorption: Methane in Zeolite Mobile Five (H-MFI). The journal of physical chemistry letters (2022)
Mauricio J Prieto, Thomas Mullan, Weiming Wan, Liviu Cristian Tanase, Lucas de Souza Caldas, Shamil Shaikhutdinov, Joachim Sauer, Denis Usvyat, Thomas Schmidt, Beatriz Roldan Cuenya
Plasma Functionalization of Silica Bilayer Polymorphs. ACS applied materials & interfaces 14 (43) (2022)
Sreekanta Debnath, Marcel Jorewitz, Knut R Asmis, Fabian Müller, Julius B Stückrath, Florian A Bischoff, Joachim Sauer
Infrared photodissociation spectroscopy of (Al 2 O 3 ) 2-5 FeO + : influence of Fe-substitution on small alumina clusters. Physical chemistry chemical physics : PCCP 24 (35) (2022)
Daria Ruth Galimberti, Joachim Sauer
Chemically Accurate Vibrational Free Energies of Adsorption from Density Functional Theory Molecular Dynamics: Alkanes in Zeolites. Journal of chemical theory and computation 17 (9) (2021)
Mauricio J Prieto, Thomas Mullan, Mark Schlutow, Daniel M Gottlob, Liviu Cristian Tanase, Dietrich Menzel, Joachim Sauer, Denis Usvyat, Thomas Schmidt, Hans-Joachim Freund
Insights into Reaction Kinetics in Confined Space: Real Time Observation of Water Formation under a Silica Cover. Journal of the American Chemical Society 143 (23) (2021)
Nikita Hanikel, Xiaokun Pei, Saumil Chheda, Hao Lyu, WooSeok Jeong, Joachim Sauer, Soumen Ghosh, Omar M Yaghi
Evolution of water structures in metal-organic frameworks for improved atmospheric water harvesting. Science (New York, N.Y.) 374 (6566) (2021)
Fabian Müller, Joachim Sauer, Xiaowei Song, Knut R Asmis
The Chemical Nature of Ti4O10-: Vibrational Predissociation Spectroscopy Combined with Global Structure Optimization. The journal of physical chemistry. A 125 (44) (2021)
Marc Reimann, Florian A Bischoff, Joachim Sauer
Thermochemistry of FeOmHnz Species: Assessment of Some DFT Functionals. Journal of chemical theory and computation 16 (4) (2020)
Ryan A Hackler, Riddhish Pandharkar, Magali S Ferrandon, In Soo Kim, Nicolaas A Vermeulen, Leighanne C Gallington, Karena W Chapman, Omar K Farha, Christopher J Cramer, Joachim Sauer, Soumen Ghosh, Alex B F Martinson, Massimiliano Delferro
Isomerization and Selective Hydrogenation of Propyne: Screening of Metal-Organic Frameworks Modified by Atomic Layer Deposition. Journal of the American Chemical Society (2020)
Fabian Berger, Joachim Sauer
Dimerization of Linear Butenes and Pentenes in an Acidic Zeolite (H-MFI). Angewandte Chemie (International ed. in English) 60 (7) (2020)
Yun Liu, Zongfang Wu, Matthias Naschitzki, Sandy Gewinner, Wieland Schöllkopf, Xiaoke Li, Joachim Paier, Joachim Sauer, Helmut Kuhlenbeck, Hans-Joachim Freund
Elucidating Surface Structure with Action Spectroscopy. Journal of the American Chemical Society 142 (5) (2020)
Fabian Müller, Julius B Stückrath, Florian A Bischoff, Soumen Ghosh, Joachim Sauer, Sreekanta Debnath, Marcel Jorewitz, Knut R Asmis
Valence and Structure Isomerism of Al2FeO4+: Synergy of Spectroscopy and Quantum Chemistry. Journal of the American Chemical Society 142 (42) (2020)
Carlo Alberto Gaggioli, Joachim Sauer, Soumen Ghosh
Hydrogen Atom or Proton Coupled Electron Transfer? C-H Bond Activation by Transition-Metal Oxides. Journal of the American Chemical Society 141 (37) (2019)
Arpan Kundu, Kaido Sillar, Joachim Sauer
Predicting adsorption selectivities from pure gas isotherms for gas mixtures in metal-organic frameworks. Chemical science 11 (3) (2019)
Joachim Sauer
Ab Initio Calculations for Molecule-Surface Interactions with Chemical Accuracy. Accounts of chemical research 52 (12) (2019)
Francesca Mirabella, Eman Zaki, Francisco Ivars-Barceló, Xiaoke Li, Joachim Paier, Joachim Sauer, Shamil Shaikhutdinov, Hans-Joachim Freund
Cooperative Formation of Long-Range Ordering in Water Ad-layers on Fe3 O4 (111) Surfaces. Angewandte Chemie (International ed. in English) 57 (5) (2018)
David Kuhness, Hyun Jin Yang, Hagen W Klemm, Mauricio Prieto, Gina Peschel, Alexander Fuhrich, Dietrich Menzel, Thomas Schmidt, Xin Yu, Shamil Shaikhutdinov, Adrian Lewandowski, Markus Heyde, Anna Kelemen, Radosław Włodarczyk, Denis Usvyat, Martin Schütz, Joachim Sauer, Hans-Joachim Freund
A Two-Dimensional 'Zigzag' Silica Polymorph on a Metal Support. Journal of the American Chemical Society 140 (19) (2018)
Marcin Rybicki, Joachim Sauer
Ab Initio Prediction of Proton Exchange Barriers for Alkanes at Brønsted Sites of Zeolite H-MFI. Journal of the American Chemical Society 140 (51) (2018)
Maristella Alessio, Denis Usvyat, Joachim Sauer
Chemically Accurate Adsorption Energies: CO and H2O on the MgO(001) Surface. Journal of chemical theory and computation 15 (2) (2018)
Matias R Fagiani, Xiaowei Song, Sreekanta Debnath, Sandy Gewinner, Wieland Schöllkopf, Knut R Asmis, Florian A Bischoff, Fabian Müller, Joachim Sauer
Dissociative Water Adsorption by Al3O4+ in the Gas Phase. The journal of physical chemistry letters 8 (6) (2017)
Chengwu Yang, Xiaojuan Yu, Stefan Heißler, Peter G Weidler, Alexei Nefedov, Yuemin Wang, Christof Wöll, Thomas Kropp, Joachim Paier, Joachim Sauer
O2 Activation on Ceria Catalysts-The Importance of Substrate Crystallographic Orientation. Angewandte Chemie (International ed. in English) 56 (51) (2017)
X Li, J Paier, Joachim Sauer, F Mirabella, E Zaki, F Ivars-Barceló, Shamil Shaikhutdinov, Hans-Joachim Freund
Surface Termination of Fe3O4(111) Films Studied by CO Adsorption Revisited. The journal of physical chemistry. B 122 (2) (2017)
Kristin Werner, Xuefei Weng, Florencia Calaza, Martin Sterrer, Thomas Kropp, Joachim Paier, Joachim Sauer, Markus Wilde, Katsuyuki Fukutani, Shamil Shaikhutdinov, Hans-Joachim Freund
Toward an Understanding of Selective Alkyne Hydrogenation on Ceria: On the Impact of O Vacancies on H2 Interaction with CeO2(111). Journal of the American Chemical Society 139 (48) (2017)
Arpan Kundu, Kaido Sillar, Joachim Sauer
Ab Initio Prediction of Adsorption Isotherms for Gas Mixtures by Grand Canonical Monte Carlo Simulations on a Lattice of Sites. The journal of physical chemistry letters 8 (12) (2017)