Florian Goeltl

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Philippe SautetProfessor, University of California, Los AngelesDirección de correo verificada de ucla.edu
Carlos CarreroR&D Oxidation - Clariant GmbHDirección de correo verificada de clariant.com
Joseph T GrantDow Coating Materials, Dow Chemical CompanyDirección de correo verificada de dow.com
Sarah E. SpechtResearch Chemist, PPG IndustriesDirección de correo verificada de braskem.com
William P. McDermottGraduate Student, University of Wisconsin - MadisonDirección de correo verificada de wisc.edu
Juan Mauricio VenegasSenior R&D Engineering Specialist, Dow Chemical CompanyDirección de correo verificada de dow.com
Carine MICHELUniv Lyon, Ecole Normale Supérieure de Lyon, CNRS, Université Lyon 1, Laboratoire de Chimie UMRDirección de correo verificada de ens-lyon.fr
Raul Francisco LoboUniversity of DelawareDirección de correo verificada de udel.edu
Craig BrownNISTDirección de correo verificada de nist.gov
Patrick WolfResearch Fellow at ETH ZürichDirección de correo verificada de chem.ethz.ch
Madelyn R BallWest Virginia UniversityDirección de correo verificada de mail.wvu.edu
Yifei LiuExxonmobilDirección de correo verificada de wisc.edu
Tomas BuckoComenius university in Bratislava, Slovak academy of sciencesDirección de correo verificada de uniba.sk
Andreas GrüneisVienna University of TechnologyDirección de correo verificada de tuwien.ac.at
Insoo RoAssistant Professor, Seoul National University of Science and TechnologyDirección de correo verificada de seoultech.ac.kr
Georg KresseUniversity of Vienna, Faculty of Physics, Professor for Computational Quantum MechanicsDirección de correo verificada de univie.ac.at
Ceri HammondRoyal Society University Research Fellow at Imperial College LondonDirección de correo verificada de imperial.ac.uk
Ellie UzunovaInstitute of general and inorganic chemistryDirección de correo verificada de svr.igic.bas.bg
Céline HouriezMINES ParisTech, Centre Thermodynamique des ProcédésDirección de correo verificada de mines-paristech.fr
Philipp Mueller

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Florian Goeltl

University of Arizona

Dirección de correo verificada de arizona.edu

Zeolites Catalysis Nanotechnology Machine Learning


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Selective oxidative dehydrogenation of propane to propene using boron nitride catalysts JT Grant, CA Carrero, F Goeltl, J Venegas, P Mueller, SP Burt, SE Specht, ... Science 354 (6319), 1570-1573, 2016	603	2016
Formation of [Cu₂O₂]²⁺ and [Cu₂O]²⁺ toward C–H Bond Activation in Cu-SSZ-13 and Cu-SSZ-39 B Ipek, MJ Wulfers, H Kim, F Goltl, I Hermans, JP Smith, KS Booksh, ... Acs Catalysis 7 (7), 4291-4303, 2017	226	2017
Van der Waals interactions between hydrocarbon molecules and zeolites: Periodic calculations at different levels of theory, from density functional theory to the random phase … F Göltl, A Grüneis, T Bučko, J Hafner The Journal of Chemical Physics 137 (11), 2012	157	2012
What makes copper-exchanged SSZ-13 zeolite efficient at cleaning car exhaust gases? F Göltl, RE Bulo, J Hafner, P Sautet The Journal of Physical Chemistry Letters 4 (14), 2244-2249, 2013	132	2013
Consequences of exchange-site heterogeneity and dynamics on the UV-visible spectrum of Cu-exchanged SSZ-13 H Li, C Paolucci, I Khurana, LN Wilcox, F Göltl, JD Albarracin-Caballero, ... Chemical science 10 (8), 2373-2384, 2019	105	2019
Computationally exploring confinement effects in the methane-to-methanol conversion over iron-oxo centers in zeolites F Goltl, C Michel, PC Andrikopoulos, AM Love, J Hafner, I Hermans, ... Acs Catalysis 6 (12), 8404-8409, 2016	100	2016
Single-atom gold oxo-clusters prepared in alkaline solutions catalyse the heterogeneous methanol self-coupling reactions S Cao, M Yang, AO Elnabawy, A Trimpalis, S Li, C Wang, F Göltl, Z Chen, ... Nature Chemistry 11 (12), 1098-1105, 2019	83	2019
Structure and properties of metal-exchanged zeolites studied using gradient-corrected and hybrid functionals. I. Structure and energetics F Göltl, J Hafner The Journal of Chemical Physics 136 (6), 064501, 2012	81	2012
Alkane adsorption in Na-exchanged chabazite: The influence of dispersion forces F Göltl, J Hafner The Journal of chemical physics 134 (6), 2011	67	2011
Synthesis gas conversion over Rh-based catalysts promoted by Fe and Mn Y Liu, F Goeltl, I Ro, MR Ball, C Sener, IB Aragão, D Zanchet, GW Huber, ... ACS catalysis 7 (7), 4550-4563, 2017	61	2017
Structure and properties of metal-exchanged zeolites studied using gradient-corrected and hybrid functionals. III. Energetics and vibrational spectroscopy of adsorbates F Göltl, J Hafner The Journal of Chemical Physics 136 (6), 064503, 2012	61	2012
Cooperative role of water molecules during the initial stage of water-induced zeolite dealumination K Stanciakova, B Ensing, F Goltl, RE Bulo, BM Weckhuysen ACS Catalysis 9 (6), 5119-5135, 2019	60	2019
Modelling the adsorption of short alkanes in protonated chabazite: The impact of dispersion forces and temperature F Göltl, J Hafner Microporous and mesoporous materials 166, 176-184, 2013	48	2013
The impact of finite temperature on the coordination of Cu cations in the zeolite SSZ-13 F Göltl, P Sautet, I Hermans Catalysis Today 267, 41-46, 2016	43	2016
Developing a descriptor-based approach for CO and NO adsorption strength to transition metal sites in zeolites F Göltl, P Müller, P Uchupalanun, P Sautet, I Hermans Chemistry of Materials 29 (15), 6434-6444, 2017	38	2017
Effect of Temperature on the Adsorption of Short Alkanes in the Zeolite SSZ-13 Adapting Adsorption Isotherms to Microporous Materials T Jiang, F Göltl, RE Bulo, P Sautet Acs Catalysis 4 (7), 2351-2358, 2014	38	2014
Can dynamics be responsible for the complex multipeak Infrared spectra of NO adsorbed to copper (II) sites in zeolites? F Göltl, P Sautet, I Hermans Angewandte Chemie International Edition 54 (27), 7799-7804, 2015	37	2015
Developing a Thermodynamic Model for the Interactions between Water and Cu in the Zeolite SSZ-13 F Göltl, AM Love, I Hermans The Journal of Physical Chemistry C 121 (11), 6160-6169, 2017	34	2017
Early stages of water/hydroxyl phase generation at transition metal surfaces–synergetic adsorption and O–H bond dissociation assistance C Michel, F Göltl, P Sautet Physical Chemistry Chemical Physics 14 (44), 15286-15290, 2012	34	2012
Thermodynamics perspective on the stepwise conversion of methane to methanol over Cu-exchanged SSZ-13 F Goltl, S Bhandari, M Mavrikakis ACS Catalysis 11 (13), 7719-7734, 2021	33	2021

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