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Materials for Energy Conversion and Storage

Günther Rupprechter (ORCID: 0000-0002-8040-1677)
  • Grant DOI 10.55776/COE5
  • Funding program Clusters of Excellence
  • Status Ongoing
  • Start October 1, 2023
  • End September 30, 2028
  • Funding amount € 20,606,870
  • Project website

Disciplines

Chemistry (50%); Nanotechnology (25%); Physics, Astronomy (25%)

Keywords

  • Energy Conversion,
  • Energy Storage,
  • Surfaces,
  • Interfaces,
  • Electrocatalysis,
  • Photocatalysis
Abstract

The continued combustion of fossil fuels to satisfy a growing energy demand have led the world to the brink of a climate crisis. We can no longer transfer carbon from the lithosphere into the atmosphere to obtain our energy, chemicals, materials, and fuels. Instead, we must re-cycle elements already present in the atmosphere or biosphere to produce recyclable carriers for renewable energy. Closing the associated water and carbon dioxide cycles will be crucial for this challenge, as this holds the key to store sustainable energy in synthetic chemicals (=fuels). Our vision is to create a leading Energy Materials Research Centre enabling the understanding and design of efficient energy conversion, paving the way towards a fossil fuel-free society. Abundant molecules such as water and carbon dioxide are the ideal feedstock for the chemical storage of energy created from renewable sources. Two potential routes are splitting water into oxygen and hydrogen, and converting carbon dioxide into higher-value products: commodity chemicals (formic acid, formaldehyde, methanol, methane as substitute natural gas), and fuels (longer-chain alkanes, olefines). The most-promising conversion processes are electrocatalysis (using electricity) and photocatalysis (using sunlight), but they suffer from low efficiencies and the need for precious metal catalysts. We need to replace rare with abundant elements or discover alternative, inexpensive catalysts with high activity, selectivity, and stability. To achieve these goals, we need to understand the fundamental processes, mechanisms, and material properties of photo- and electrocatalysts at the most basic, the atomic scale. We also need to establish how the surfaces/interfaces function on a molecular level over a wide parameter range, particularly under the working conditions of the catalysts. A long-term secondary goal of MECS will be to transfer the fundamental understanding and design of advanced energy materials to applications via interactions with industry and relevant stakeholders. The multi-faceted nature of the problem calls for a interdisciplinary approach exploiting synergies and cross- fertilization. This COE brings together our country`s best minds and provides them with the means to cooperate and create a sustainable network that promises scientific breakthroughs and attracts future talent. The team includes experts in physics, chemistry, surface and material science, and leaders in computational modeling. Promoting young scientists, the COE includes a structured doctorate program for PhDs and special training for postdocs and early career researchers. Interactions with stakeholders will be intertwined with scientific and technical studies. The Board of Directors includes Ulrike Diebold (TU Wien), Stefan Freunberger (IST Austria), Leticia Gonzlez (Universität Wien), Julia Kunze-Liebhäuser (Universität Innsbruck), and Günther Rupprechter (TU Wien; Director of Research).

Consortium
  • Ulrike Diebold, Technische Universität Wien
    Board of Directors (01.10.2023 -)
  • Günther Rupprechter, Technische Universität Wien
    Director of Research (01.10.2023 -)
  • Leticia Gonzalez, Universität Wien
    Board of Directors (01.10.2023 -)
  • Stefan Freunberger, Institute of Science and Technology - Austria (ISTA)
    Board of Directors (01.10.2023 -)
  • Julia Kunze-Liebhäuser, Universität Innsbruck
    Board of Directors (01.10.2023 -)
Key Researchers
  • Bingqing Cheng, Institute of Science and Technology - Austria (ISTA) (31.3.2023 -)
  • Alexander Opitz, Technische Universität Wien (31.3.2023 -)
  • Alexey Cherevan, Technische Universität Wien (31.3.2023 -)
  • Dominik Eder, Technische Universität Wien (31.3.2023 -)
  • Florian Libisch, Technische Universität Wien (31.3.2023 -)
  • Gareth Parkinson, Technische Universität Wien (31.3.2023 -)
  • Georg Kent Hellerup Madsen, Technische Universität Wien (31.3.2023 -)
  • Jürgen Fleig, Technische Universität Wien (31.3.2023 -)
  • Katharina Schröder, Technische Universität Wien (31.3.2023 -)
  • Markus Valtiner, Technische Universität Wien (31.3.2023 -)
  • Davide Bonifazi, Universität Wien (31.3.2023 -)
  • Georg Kresse, Universität Wien (31.3.2023 -)
  • Jani Kotakoski, Universität Wien (31.3.2023 -)
Associated Researchers
  • Christoph Rameshan, Montanuniversität Leoben (3.7.2024 -)
Research institution(s)
  • Institute of Science and Technology - Austria (ISTA) - 8%
  • Technische Universität Wien - 72%
  • Universität Innsbruck - 4%
  • Universität Wien - 16%
International project participants
  • Jan Rossmeisl, University of Copenhagen - Denmark
  • Andreas Stierle, Deutsches Elektronensynchrotron - Germany
  • Norbert H. Menzler, Forschungszentrum Jülich - Germany
  • Martin Bram, Forschungszentrum Jülich GmbH - Germany
  • Karsten Reuter, Fritz-Haber-Institut d. Max-Planck-Gesellschaft Berlin - Germany
  • Aliaksandr Bandarenka, Technical University of Munich - Germany
  • Nicola Armaroli, ISOF - Italy
  • Luca Gregoratti, Elettra-Sincrotrone Trieste - Italy
  • Livia B. Pártay, University of Warwick

Research Output

  • 138 Publications
  • 1 Patents
  • 1 Policies
  • 19 Disseminations
  • 45 Scientific Awards
  • 14 Fundings
Publications
  • 2026
    Title Atomically clean free-standing two-dimensional materials through heating in ultra-high vacuum
    DOI 10.1088/2053-1583/ae33d1
    Type Journal Article
    Author Irschik P
    Journal 2D Materials
  • 2026
    Title In situ Raman study on sulfur vacancies in monolayer MoS 2
    DOI 10.1088/2053-1583/ae6b2b
    Type Journal Article
    Author Daniel L
    Journal 2D Materials
  • 2026
    Title The Oxygen Partial Pressure Dependence of Space Charges at SrTiO3|Mixed Ionic Electronic Conducting Oxide Heterojunctions.
    DOI 10.1002/smtd.202500728
    Type Journal Article
    Author Steinbach C
    Journal Small methods
  • 2026
    Title Probing the structure of D 2 O ice layers on ALD-grown ZrO 2 , Al 2 O 3 and TiO 2 thin films by sum frequency generation (SFG) spectroscopy
    DOI 10.1039/d5fd00152h
    Type Journal Article
    Author Li X
    Journal Faraday Discussions
  • 2026
    Title CO on a Rh/Fe3O4 single-atom catalyst: high-resolution infrared spectroscopy and near-ambient-pressure scanning tunnelling microscopy.
    DOI 10.1039/d5fd00158g
    Type Journal Article
    Author Barama Neh
    Journal Faraday discussions
  • 2026
    Title Extending SHARC to Periodic Systems: A SHARC-VASP Interface for First-Principles Nonadiabatic Dynamics
    DOI 10.1021/acs.jctc.6c01191
    Type Journal Article
    Author Romanelli M
    Journal Journal of Chemical Theory and Computation
  • 2026
    Title From batch to flow plasmon catalysis: revealing mass transport limits in Au@Pd nanocatalysts for Suzuki coupling.
    DOI 10.1039/d5nr03832d
    Type Journal Article
    Author Erzina M
    Journal Nanoscale
    Pages 5357-5370
  • 2026
    Title Laser writing of plasmonic catalytic microchannels on UiO-66 layer.
    DOI 10.1039/d5nr05068e
    Type Journal Article
    Author Gorbunova A
    Journal Nanoscale
    Pages 6369-6380
  • 2026
    Title Cu-doped perovskites: Tuning methanol steam reforming performance
    DOI 10.1016/j.cej.2026.177447
    Type Journal Article
    Author Berger T
    Journal Chemical Engineering Journal
  • 2026
    Title The redox chemistry of La0.5Sr0.5Cr0.2Mn0.8O3- and its application in high capacity anodes of oxygen ion batteries.
    DOI 10.1039/d6ta00585c
    Type Journal Article
    Author Wagner B
    Journal Journal of materials chemistry. A
    Pages 25240-25254
  • 2026
    Title Sulfone-decorated hypercrosslinked polymers for sacrificial light-driven hydrogen evolution from water.
    DOI 10.1039/d6ta01673a
    Type Journal Article
    Author Schweng P
    Journal Journal of materials chemistry. A
    Pages 31624-31631
  • 2026
    Title Engineering hierarchical porosity in MOFs for host-guest chemistry with large organometallic complexes.
    DOI 10.1039/d6ta02595a
    Type Journal Article
    Author Blaschke J
    Journal Journal of materials chemistry. A
    Pages 27667-27682
  • 2026
    Title Valorization of pineapple leaf waste into Fe-Modified biochar for efficient H2S adsorption.
    DOI 10.1016/j.biortech.2026.134556
    Type Journal Article
    Author Chanka N
    Journal Bioresource technology
    Pages 134556
  • 2026
    Title Guided Adaptive Diffusion: An Evolutionary Framework for Multimodal Atomistic Structure Prediction.
    DOI 10.1021/acs.jcim.6c00843
    Type Journal Article
    Author Adel A
    Journal Journal of chemical information and modeling
  • 2026
    Title A XANES study of Cu adatom coordination on Fe3O4(001).
    DOI 10.1039/d5cc04046a
    Type Journal Article
    Author Eratam F
    Journal Chemical communications (Cambridge, England)
  • 2026
    Title Nanoporous BNC network on Au(111) from a borazine-based arylalkyne.
    DOI 10.1039/d5cc07416a
    Type Journal Article
    Author Ibarra-Barreno Cm
    Journal Chemical communications (Cambridge, England)
    Pages 6945-6949
  • 2026
    Title Photocatalytic upcycling of PET into methane, hydrogen and high-value liquid products.
    DOI 10.1039/d5gc03562g
    Type Journal Article
    Author Weisweiller M
    Journal Green chemistry : an international journal and green chemistry resource : GC
    Pages 309-317
  • 2026
    Title In-situ surface reconstruction of silver-based MOCHAs via chalcogen depletion for durable CO-to-CO electrocatalysis
    DOI 10.1016/j.jcou.2026.103488
    Type Journal Article
    Author Rabl-Wolff H
    Journal Journal of CO2 Utilization
  • 2026
    Title Photocatalytic Ammonia Synthesis using Fe-Based MOFs: The Role of Ligand Functionalization.
    DOI 10.1021/jacs.5c22833
    Type Journal Article
    Author Bischoff J
    Journal Journal of the American Chemical Society
    Pages 21382-21392
  • 2026
    Title Single photon emitters in hBN: Limitations of atomic resolution imaging and potential sources of error.
    DOI 10.1016/j.ultramic.2026.114318
    Type Journal Article
    Author Lamprecht D
    Journal Ultramicroscopy
    Pages 114318
  • 2026
    Title Designing effective single-molecule electromagnets with radially -conjugated carbon structures
    DOI 10.1038/s41467-026-74365-6
    Type Journal Article
    Author Shi W
    Journal Nature Communications
  • 2026
    Title Band Alignment in Ultrathin Mixed Conducting Oxide Layers.
    DOI 10.1021/acsami.6c08854
    Type Journal Article
    Author Steinbach C
    Journal ACS applied materials & interfaces
    Pages 34596-34607
  • 2026
    Title Active learning potentials for first-principles phase diagrams using replica-exchange nested sampling.
    DOI 10.1038/s41524-026-01989-z
    Type Journal Article
    Author Unglert N
    Journal npj computational materials
    Pages 107
  • 2026
    Title Structural and Plasmonic Evolution in Mixed-Dimensionality Bismuth/Graphene Heterostructures.
    DOI 10.1021/acsami.5c20752
    Type Journal Article
    Author Gupta T
    Journal ACS applied materials & interfaces
    Pages 15430-15443
  • 2026
    Title Quantitative Modeling of Nanopore Formation in 2D MoS2 by Swift Heavy-Ion Irradiation.
    DOI 10.1021/acsami.5c20044
    Type Journal Article
    Author Liebsch Y
    Journal ACS applied materials & interfaces
    Pages 7237-7248
  • 2026
    Title Upcycling Pond Coal Ash for CO Oxidation: An Operando Spectroscopic Study
    DOI 10.1021/acssusresmgt.6c00299
    Type Journal Article
    Author Maqbool Q
    Journal ACS Sustainable Resource Management
  • 2026
    Title Origin of circular and triangular pores in electron-irradiated hexagonal boron nitride
    DOI 10.1038/s41467-026-76612-2
    Type Journal Article
    Author Javed U
    Journal Nature Communications
  • 2026
    Title Low curvature combined with high amorphization improves SERS sensitivity of semiconducting Rh-Se mesoporous nanospheres toward non-adsorbing resistant pollutants.
    DOI 10.1038/s41467-026-75365-2
    Type Journal Article
    Author Kang Y
    Journal Nature communications
  • 2026
    Title Vibrationally Induced Resonances in Lasing.
    DOI 10.1021/acs.jpclett.5c04028
    Type Journal Article
    Author Müller K
    Journal The journal of physical chemistry letters
    Pages 5275-5279
  • 2026
    Title Multiscale Microscopy via Automation: Dual Magnification Environmental Scanning Electron Microscopy Imaging by Frame Alternation
    DOI 10.1002/admt.202600009
    Type Journal Article
    Author Vuijk M
    Journal Advanced Materials Technologies
  • 2026
    Title Hydrogen Activation via Dihydride Formation on a Rh1/Fe3O4(001) Single-Atom Catalyst.
    DOI 10.1002/anie.202525745
    Type Journal Article
    Author Wang C
    Journal Angewandte Chemie (International ed. in English)
  • 2026
    Title Benzoyl-Xanthenoxanthenes: Versatile Chromophores for Light-Engaging Applications.
    DOI 10.1002/anie.202523349
    Type Journal Article
    Author De Luca C
    Journal Angewandte Chemie (International ed. in English)
  • 2026
    Title Thermoelectrics-Mediated Photon-Phonon-Electron Coupling Enables Unconventional Thermal Contributions in Plasmonic Catalysis
    DOI 10.1002/adfm.77363
    Type Journal Article
    Author Ma Y
    Journal Advanced Functional Materials
  • 2026
    Title Facet-Selective Electrostatic Assembling of 2D MXene onto Anisotropic Single-Crystal Metal Oxides for Enhanced Photocatalysis.
    DOI 10.1002/adma.202519087
    Type Journal Article
    Author Kashiwaya S
    Journal Advanced materials (Deerfield Beach, Fla.)
  • 2026
    Title Entropic-dielectric interplay governs ion adsorption in inner electric double layers.
    DOI 10.1126/sciadv.aee9469
    Type Journal Article
    Author Olgiati M
    Journal Science advances
  • 2026
    Title Atomically Precise Cluster Cocatalysts: Missing Link toward Heterogenized Photocatalytic Systems.
    DOI 10.1021/acsnano.5c15286
    Type Journal Article
    Author Nagaraju Myakala S
    Journal ACS nano
    Pages 99-118
  • 2026
    Title How Realistic Are Idealized Copper Surfaces? A Machine Learning Study of Rough Copper-Water Interfaces.
    DOI 10.1021/acsmaterialsau.5c00174
    Type Journal Article
    Author Erhard Lc
    Journal ACS materials Au
    Pages 379-389
  • 2026
    Title Oxide Growth and Place-Exchange on Au(111) in Alkaline Electrolyte.
    DOI 10.1021/acselectrochem.5c00505
    Type Journal Article
    Author Moser T
    Journal ACS electrochemistry
    Pages 726-734
  • 2026
    Title Revisiting MOF-Derived Single-Atom Electrocatalysts: Limitations, Characterizations, and Design Strategies.
    DOI 10.1021/acs.nanolett.5c05986
    Type Journal Article
    Author Huang Z
    Journal Nano letters
    Pages 1152-1162
  • 2026
    Title Facile and Fast Microwave-Assisted Synthesis of Metalated PCN-222 for Light-Driven Hydrogen Evolution Reaction
    DOI 10.1021/acsomega.6c01020
    Type Journal Article
    Author Ebrahimi A
    Journal ACS Omega
  • 2026
    Title Substrate-dependent pore formation in molybdenum disulfide monolayers under ion irradiation.
    DOI 10.3762/bjnano.17.54
    Type Journal Article
    Author Liebsch Y
    Journal Beilstein journal of nanotechnology
    Pages 769-780
  • 2025
    Title "Single-atom" catalysis: An opportunity for surface science
    DOI 10.1016/j.susc.2024.122687
    Type Journal Article
    Author Parkinson G
    Journal Surface Science
  • 2025
    Title Rationalizing the "anomalous" electrochemical Stark shift of CO at Pt(111) through vibrational spectroscopy and density-functional theory calculations
    DOI 10.1016/j.susc.2025.122694
    Type Journal Article
    Author Diesen E
    Journal Surface Science
  • 2025
    Title Quantifying protons in triple conducting perovskite-type oxides via laser-induced breakdown spectroscopy - A comparative validation approach
    DOI 10.1016/j.ssi.2025.117033
    Type Journal Article
    Author Maurer M
    Journal Solid State Ionics
  • 2025
    Title Computing anharmonic infrared spectra of polycyclic aromatic hydrocarbons using machine learning molecular dynamics
    DOI 10.1093/mnras/staf1156
    Type Journal Article
    Author Mai X
    Journal Monthly Notices of the Royal Astronomical Society
  • 2025
    Title Online Coupling High-Temperature Electrolysis with Carbonylation Reactions: A Powerful Method for Continuous Carbon Dioxide Utilization
    DOI 10.1002/ange.202420578
    Type Journal Article
    Author Stagel K
    Journal Angewandte Chemie
  • 2025
    Title Uncovering the Atomic Structure of Substitutional Platinum Dopants in MoS2 with Single-Sideband Ptychography.
    DOI 10.1021/acs.nanolett.5c00919
    Type Journal Article
    Author Lamprecht D
    Journal Nano letters
    Pages 8931-8938
  • 2025
    Title Strain Control of Valley Polarization Dynamics in a 2D Semiconductor via Exciton Hybridization.
    DOI 10.1021/acs.nanolett.5c02636
    Type Journal Article
    Author Kumar Am
    Journal Nano letters
    Pages 15164-15172
  • 2025
    Title Upcycling hazardous waste into high-performance Ni/-Al2O3 catalysts for CO2 methanation.
    DOI 10.1039/d4gc05217j
    Type Journal Article
    Author Maqbool Q
    Journal Green chemistry : an international journal and green chemistry resource : GC
    Pages 2706-2722
  • 2025
    Title Absolute standard hydrogen electrode potential and redox potentials of atoms and molecules: machine learning aided first principles calculations.
    DOI 10.1039/d4sc03378g
    Type Journal Article
    Author Jinnouchi R
    Journal Chemical science
    Pages 2335-2343
  • 2025
    Title The dark side of metal exsolution: a combined in situ surface spectroscopic and electrochemical study on perovskite-type cathodes for high-temperature CO 2 electrolysis
    DOI 10.1039/d5ey00013k
    Type Journal Article
    Author Melcher C
    Journal EES Catalysis
  • 2025
    Title Calcium-Functionalized MgCeAl-Supported Nickel Catalysts for Enhancing Syngas Production via Dry Reforming.
    DOI 10.1021/acs.iecr.5c00941
    Type Journal Article
    Author Phichairatanaphong O
    Journal Industrial & engineering chemistry research
    Pages 11782-11793
  • 2025
    Title From flat to stepped: active learning frameworks for investigating local structure at copper-water interfaces.
    DOI 10.1039/d5cp00396b
    Type Journal Article
    Author Schörghuber J
    Journal Physical chemistry chemical physics : PCCP
    Pages 9169-9177
  • 2025
    Title The surface phase diagram of Fe3O4(001) revisited.
    DOI 10.1039/d5lf00022j
    Type Journal Article
    Author Sombut P
    Journal RSC applied interfaces
    Pages 673-683
  • 2025
    Title Molecular arrangements in the first monolayer of Cu-phthalocyanine on In2O3(111).
    DOI 10.1039/d5tc01394a
    Type Journal Article
    Author Blatnik Ma
    Journal Journal of materials chemistry. C
    Pages 17650-17661
  • 2025
    Title Reducibility, adsorption energies, surface acidity - fundamental material properties for fast oxygen exchange.
    DOI 10.1039/d5ta05637c
    Type Journal Article
    Author Siebenhofer M
    Journal Journal of materials chemistry. A
    Pages 29885-29899
  • 2025
    Title Engineering active intermetallic Pt-Zn sites via vapour-solid synthesis for photocatalytic hydrogen production.
    DOI 10.1039/d5se00487j
    Type Journal Article
    Author Garstenauer D
    Journal Sustainable energy & fuels
    Pages 3283-3292
  • 2025
    Title Multi-technique characterization of rhodium gem-dicarbonyls on TiO 2 (110)
    DOI 10.1039/d5sc04889c
    Type Journal Article
    Author Eder M
    Journal Chemical Science
  • 2025
    Title Corrugation-Dominated Mechanical Softening of Defect-Engineered Graphene.
    DOI 10.1103/physrevlett.134.166102
    Type Journal Article
    Author Joudi W
    Journal Physical review letters
    Pages 166102
  • 2025
    Title Dynamics of Adatom and Vacancy Islands on Au(111) in Alkaline and Acidic Media.
    DOI 10.1021/acs.jpcc.5c03661
    Type Journal Article
    Author Moser T
    Journal The journal of physical chemistry. C, Nanomaterials and interfaces
    Pages 14411-14417
  • 2025
    Title Local Geometry, Structure and Electronic Resonances Enhancing the SFG Signal from CO on Ir Surfaces.
    DOI 10.1021/acs.jpcc.5c02545
    Type Journal Article
    Author Li X
    Journal The journal of physical chemistry. C, Nanomaterials and interfaces
    Pages 12551-12560
  • 2025
    Title Efficient Excitonic Configuration Interaction for Large-Scale Multichromophoric Systems Using the Resolution-of-Identity Approximation.
    DOI 10.1021/acs.jpclett.5c00065
    Type Journal Article
    Author Piteša T
    Journal The journal of physical chemistry letters
    Pages 2800-2807
  • 2025
    Title Mechanistic Insights into CO and H2 Oxidation on Cu/CeO2 Single Atom Catalysts: A Computational Investigation
    DOI 10.1007/s11244-025-02102-2
    Type Journal Article
    Author Tangpakonsab P
    Journal Topics in Catalysis
  • 2025
    Title Harnessing the structural evolution of metal-organic frameworks under electrocatalytic conditions.
    DOI 10.1038/s42004-025-01747-0
    Type Journal Article
    Author Huang Z
    Journal Communications chemistry
    Pages 359
  • 2025
    Title Surface Chemistry of WC Powder Electrocatalysts Probed In Situ with NAP-XPS.
    DOI 10.1002/anie.202500965
    Type Journal Article
    Author Griesser C
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title Quantifying Asymmetric Coordination to Correlate with Oxygen Reduction Activity in Fe-Based Single-Atom Catalysts.
    DOI 10.1002/anie.202423556
    Type Journal Article
    Author Cao Y
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title Spin Frustration Determines the Stability and Reactivity of Metal-Organic Frameworks with Triangular Iron(III)-Oxo Clusters.
    DOI 10.1002/anie.202514014
    Type Journal Article
    Author Lechner P
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title Online Coupling High-Temperature Electrolysis with Carbonylation Reactions: A Powerful Method for Continuous Carbon Dioxide Utilization.
    DOI 10.1002/anie.202420578
    Type Journal Article
    Author Stagel K
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title Engineering of HO-Zn-N2 Active Sites in Zeolitic Imidazolate Frameworks for Enhanced (Photo)Electrocatalytic Hydrogen Evolution.
    DOI 10.1002/anie.202419913
    Type Journal Article
    Author Huang Z
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title BN/BO Doping of peri-Acenoacenes: Modulating Excited States in Trapeziumene Congeners.
    DOI 10.1002/anie.202517114
    Type Journal Article
    Author Poletto D
    Journal Angewandte Chemie (International ed. in English)
  • 2025
    Title The density isobar of water: A comparative study of vdW-DF-cx and RPBE-D3.
    DOI 10.1063/5.0278026
    Type Journal Article
    Author Bučková N
    Journal The Journal of chemical physics
  • 2025
    Title A machine learning approach to predict tight-binding parameters for point defects via the projected density of states
    DOI 10.1038/s41524-025-01634-1
    Type Journal Article
    Author Fried H
    Journal npj Computational Materials
  • 2025
    Title Development of spectroelectrochemical microscopy for the real-time study of electrochemical surface processes
    DOI 10.1038/s41529-025-00728-x
    Type Journal Article
    Author Olgiati M
    Journal npj Materials Degradation
  • 2025
    Title Quantifying the distinct role of plasmon enhancement mechanisms in prototypical antenna-reactor photocatalysts.
    DOI 10.1038/s41467-025-57569-0
    Type Journal Article
    Author Liu S
    Journal Nature communications
    Pages 2245
  • 2026
    Title Closing the Carbon Loop: Continuous-Flow Synthesis of N-Aroyl Sulfoximines via Electrochemical CO2 Reduction.
    DOI 10.1002/cssc.70810
    Type Journal Article
    Author Moroni G
    Journal ChemSusChem
  • 2026
    Title Machine-Learned Force Fields for Lattice Dynamics at Coupled-Cluster Level Accuracy.
    DOI 10.1021/acs.jctc.6c00854
    Type Journal Article
    Author Schönbauer S
    Journal Journal of chemical theory and computation
    Pages 6906-6916
  • 2026
    Title Revealing the Intricate Structure of Surface Phases of Methanol on In2O3(111).
    DOI 10.1021/acs.jpcc.5c07043
    Type Journal Article
    Author Ziegler A
    Journal The journal of physical chemistry. C, Nanomaterials and interfaces
    Pages 2341-2351
  • 2026
    Title Dynamical properties of abinitio water from machine-learning potentials.
    DOI 10.1063/5.0348453
    Type Journal Article
    Author Montero De Hijes P
    Journal The Journal of chemical physics
  • 2026
    Title Accurate thermophysical properties of water using machine-learned potentials.
    DOI 10.1063/5.0325444
    Type Journal Article
    Author Hilpert T
    Journal The Journal of chemical physics
  • 2026
    Title Proton Activity as a Promoter for the CO2 Electroreduction to Formic Acid in Acidic Media.
    DOI 10.1002/cssc.70906
    Type Journal Article
    Author Mairegger T
    Journal ChemSusChem
  • 2026
    Title Molecular-Polymeric Hybrid Photocathodes for CO 2 Reduction: A Modular Approach to Sustainable Photoelectrocatalysis
    DOI 10.1002/celc.70219
    Type Journal Article
    Author Hulaj B
    Journal ChemElectroChem
  • 2026
    Title Scalar machine learning of tensorial quantities-Born effective charges from monopole models.
    DOI 10.1063/5.0327083
    Type Journal Article
    Author Schmiedmayer B
    Journal The Journal of chemical physics
  • 2026
    Title Unexpected Reactivity of Zirconium Carbide on Nickel/Yttria-Stabilized Zirconia Boosts CO2/H2O Co-electrolysis to Methane.
    DOI 10.1021/acs.chemmater.6c00480
    Type Journal Article
    Author Thurner Cw
    Journal Chemistry of materials : a publication of the American Chemical Society
    Pages 7637-7648
  • 2026
    Title Steering Langevin Dynamics toward Transition States Using Collective-Variable-Free Resampling.
    DOI 10.1021/acs.jctc.6c00679
    Type Journal Article
    Author Ketter M
    Journal Journal of chemical theory and computation
    Pages 5797-5806
  • 2026
    Title Hierarchical on-surface assembly of nanoribbons through concurrent hydrogen- and chalcogen-bonding interactions.
    DOI 10.1039/d5sc08883f
    Type Journal Article
    Author Caporale A
    Journal Chemical science
    Pages 13148-13154
  • 2025
    Title Current-induced brightening of vacancy-related emitters in hexagonal boron nitride
    DOI 10.1103/cd62-5hq8
    Type Journal Article
    Author Steiner C
    Journal Physical Review Research
  • 2025
    Title Efficient periodic density functional theory calculations of charged molecules and surfaces using Coulomb kernel truncation
    DOI 10.1103/cd6s-cdkf
    Type Journal Article
    Author Vijay S
    Journal Physical Review B
  • 2025
    Title Neue Materialien für Energieumwandlung und -speicherung: Aktuelle Forschung am Lehrstuhl für Physikalische Chemie
    DOI 10.1007/s00501-025-01573-w
    Type Journal Article
    Author Ruh T
    Journal BHM Berg- und Hüttenmännische Monatshefte
  • 2025
    Title Identifying Electronic Doorway States in Secondary Electron Emission from Layered Materials
    DOI 10.1103/qls7-tr4v
    Type Journal Article
    Author Niggas A
    Journal Physical Review Letters
  • 2025
    Title From Batch to Flow Plasmon Catalysis: Revealing Mass Transport Limits inAu@Pd Nanocatalysts for Suzuki Coupling
    DOI 10.26434/chemrxiv-2025-mmcv4
    Type Preprint
    Author Erzina M
  • 2025
    Title Steering Langevin dynamics towards transition states using collective-variable-free resampling
    DOI 10.26434/chemrxiv-2025-1psv7
    Type Preprint
    Author Ketter M
  • 2025
    Title Green Syngas from Photothermal Catalytic Cellulose Steam Reforming on Ni/SiO2 Nanocatalysts: Synergy of La3+ Promotion and Ni-O Photoactivation.
    DOI 10.1002/smll.202411977
    Type Journal Article
    Author Wu J
    Journal Small (Weinheim an der Bergstrasse, Germany)
  • 2025
    Title Revising Model Reactions in Plasmonic Chemistry: From Nitrothiophenol Coupling to Alkoxyamine Homolysis.
    DOI 10.1021/acscatal.5c01129
    Type Journal Article
    Author Gorbunova A
    Journal ACS catalysis
    Pages 11163-11176
  • 2025
    Title Synergy of Oxygen and Water in Ceria-Catalyzed Direct Conversion of Methane to Methanol under Continuous Flow.
    DOI 10.1021/acscatal.5c05829
    Type Journal Article
    Author Li W
    Journal ACS catalysis
    Pages 20496-20511
  • 2025
    Title Using Sorbitol as Electrolyte Additive to Control Interfacial Environments in Electrochemical CO2 Reduction on Silver.
    DOI 10.1021/acscatal.5c04382
    Type Journal Article
    Author Sihag Ak
    Journal ACS catalysis
    Pages 16643-16652
  • 2025
    Title Influence of MXene and TiO2 on the Performance of Microalgae-Derived Ru-Based Catalysts for CO2 Hydrogenation to Methane.
    DOI 10.1021/acscatal.5c04285
    Type Journal Article
    Author Sidorowicz A
    Journal ACS catalysis
    Pages 15261-15278
  • 2025
    Title Engineering Catalytic Efficiency by Thiolate-Protected Trimetallic (Cu, Pd, Au) Nanoclusters: Single-Atom Alloy Catalysts for Water-Gas Shift.
    DOI 10.1021/acscatal.5c04165
    Type Journal Article
    Author Pollitt S
    Journal ACS catalysis
    Pages 15459-15474
  • 2025
    Title Femtosecond Laser Generation of LaCoO3 Perovskite Nanocatalysts for Preferential CO Oxidation.
    DOI 10.1021/acsanm.5c03993
    Type Journal Article
    Author Lasemi N
    Journal ACS applied nano materials
    Pages 21948-21963
  • 2025
    Title Space Charges at SrTiO3|Mixed Ionic and Electronic Conducting Oxide Heterojunctions and Their Relation to Defect Chemistry.
    DOI 10.1021/acsami.4c21843
    Type Journal Article
    Author Steinbach C
    Journal ACS applied materials & interfaces
    Pages 17543-17557
  • 2025
    Title Strategic Secondary Ligand Selection for Enhanced Pore-Type Construction and Water Purification Capacity in Zeolitic Imidazolate Frameworks.
    DOI 10.1021/acsami.4c21221
    Type Journal Article
    Author Huang Z
    Journal ACS applied materials & interfaces
    Pages 21133-21142
  • 2025
    Title Basal-Plane Pores Activate Monolayer MoS 2 for the Hydrogen Evolution Reaction
    DOI 10.1021/acscatal.4c07970
    Type Journal Article
    Author Fruehwald H
    Journal ACS Catalysis
  • 2025
    Title Stacking Mode-Driven Enhancement of Optoelectronic and Electrocatalytic Properties in Bilayer 2H MoS2.
    DOI 10.1021/acsami.5c11713
    Type Journal Article
    Author Aggarwal V
    Journal ACS applied materials & interfaces
    Pages 48658-48669
  • 2025
    Title Boosting Formic Acid Production in Mildly Acidic MediaThe Role of Native Surface Oxide on the CO2 Reduction Performance.
    DOI 10.1021/acsomega.5c10136
    Type Journal Article
    Author Mairegger T
    Journal ACS omega
    Pages 56863-56869
  • 2025
    Title Elucidation of a Core-Shell Structure in Phenyl-Grafted Carbon Nitride/TiO2 Nanohybrids for Visible-Light-Mediated H2 Production with Simultaneous Rhodamine B Degradation.
    DOI 10.1021/acsanm.4c05592
    Type Journal Article
    Author Hazra M
    Journal ACS applied nano materials
    Pages 1683-1699
  • 2025
    Title BN/BO Doping of peri -Acenoacenes: Modulating Excited States in Trapeziumene Congeners
    DOI 10.1002/ange.202517114
    Type Journal Article
    Author Poletto D
    Journal Angewandte Chemie
  • 2025
    Title Spinfrustration bestimmt Stabilität und Reaktivität von metallorganischen Gerüstverbindungen mit dreieckigen Eisen(III)-Oxo-Clustern
    DOI 10.1002/ange.202514014
    Type Journal Article
    Author Lechner P
    Journal Angewandte Chemie
  • 2025
    Title Surface Chemistry of WC Powder Electrocatalysts Probed In Situ with NAP-XPS
    DOI 10.1002/ange.202500965
    Type Journal Article
    Author Griesser C
    Journal Angewandte Chemie
  • 2025
    Title Quantifying Asymmetric Coordination to Correlate with Oxygen Reduction Activity in Fe-Based Single-Atom Catalysts
    DOI 10.1002/ange.202423556
    Type Journal Article
    Author Cao Y
    Journal Angewandte Chemie
  • 2025
    Title Marcus kinetics control singlet and triplet oxygen evolving from superoxide.
    DOI 10.1038/s41586-025-09587-7
    Type Journal Article
    Author Mondal S
    Journal Nature
    Pages 601-605
  • 2025
    Title Combining Electrochemical Scanning Tunneling Microscopy with Force Microscopy.
    DOI 10.1021/acsnano.5c00591
    Type Journal Article
    Author Auer A
    Journal ACS nano
    Pages 8401-8410
  • 2025
    Title Facet-Dependent Restructuring and Catalytic Activity of Cu Single Crystals during CO Electro-Oxidation.
    DOI 10.1021/acsnano.5c13881
    Type Journal Article
    Author Leitner M
    Journal ACS nano
    Pages 42310-42318
  • 2025
    Title Two-Dimensional One-Atom-Thick Gold Grown on Defect-Engineered Graphene.
    DOI 10.1021/acsnano.5c01538
    Type Journal Article
    Author Joudi W
    Journal ACS nano
    Pages 22032-22043
  • 2024
    Title Single atoms and metal nanoclusters anchored to graphene vacancies.
    DOI 10.1016/j.micron.2024.103667
    Type Journal Article
    Author Trentino A
    Journal Micron (Oxford, England : 1993)
    Pages 103667
  • 2024
    Title Individual Marcus-type kinetics controls singlet and triplet oxygen evolution from superoxide
    DOI 10.26434/chemrxiv-2024-3vrzz
    Type Preprint
    Author Mondal S
  • 2024
    Title MOCHAs: An Emerging Class of Materials for Photocatalytic H2 Production.
    DOI 10.1002/smll.202400348
    Type Journal Article
    Author Nagaraju Myakala S
    Journal Small (Weinheim an der Bergstrasse, Germany)
  • 2024
    Title Automated image acquisition and analysis of graphene and hexagonal boron nitride from pristine to highly defective and amorphous structures.
    DOI 10.1038/s41598-024-77740-9
    Type Journal Article
    Author Propst D
    Journal Scientific reports
    Pages 26939
  • 2024
    Title Oxygen Vacancies and Ti 3+ In-Gap Defects Dictate Photocatalytic H 2 Generation in BaTiO 3
    DOI 10.1021/acsaem.4c02142
    Type Journal Article
    Author Chandrappa S
    Journal ACS Applied Energy Materials
  • 2024
    Title Defect-Rich CuZn Nanoparticles for Model Catalysis Produced by Femtosecond Laser Ablation.
    DOI 10.1021/acsami.4c07766
    Type Journal Article
    Author Lasemi N
    Journal ACS applied materials & interfaces
    Pages 38163-38176
  • 2024
    Title The Relevance of the Interfacial Water Reactivity for Electrochemical CO Reduction on Copper Single Crystals.
    DOI 10.1021/acscatal.3c02700
    Type Journal Article
    Author Winkler D
    Journal ACS catalysis
    Pages 1098-1106
  • 2024
    Title Highly Active W2C-Based Composites for the HER in Alkaline Solution: the Role of Surface Oxide Species.
    DOI 10.1021/acsami.4c01612
    Type Journal Article
    Author Díaz-Coello S
    Journal ACS applied materials & interfaces
    Pages 21877-21884
  • 2024
    Title Role of Interfacial Hydrogen in Ethylene Hydrogenation on Graphite-Supported Ag, Au, and Cu Catalysts.
    DOI 10.1021/acscatal.4c05246
    Type Journal Article
    Author Wicht T
    Journal ACS catalysis
    Pages 16905-16919
  • 2024
    Title A thiomolybdate cluster for visible-light-driven hydrogen evolution: comparison of homogeneous and heterogeneous approaches.
    DOI 10.1039/d3se01658g
    Type Journal Article
    Author Batool S
    Journal Sustainable energy & fuels
    Pages 1225-1235
  • 2024
    Title Thiomolybdate Clusters: From Homogeneous Catalysis to Heterogenization and Active Sites.
    DOI 10.1002/adma.202305730
    Type Journal Article
    Author Batool S
    Journal Advanced materials (Deerfield Beach, Fla.)
  • 2024
    Title Spatially Resolved Uncertainties for Machine Learning Potentials.
    DOI 10.1021/acs.jcim.4c00904
    Type Journal Article
    Author Heid E
    Journal Journal of chemical information and modeling
    Pages 6377-6387
  • 2024
    Title Mechanistic Insights into CO and H2 Oxidation on Cu/CeO2 Single Atom Catalysts: A Computational Investigation
    DOI 10.26434/chemrxiv-2024-q61wb
    Type Preprint
    Author Tangpakonsab P
  • 2024
    Title Rationalizing the "Anomalous" Electrochemical Stark Shift of CO at Pt(111) Through Vibrational Spectroscopy and Density-Functional Theory Calculations
    DOI 10.26434/chemrxiv-2024-kpfsl
    Type Preprint
    Author Diesen E
  • 2024
    Title Spatially resolved uncertainties for machine learning potentials
    DOI 10.26434/chemrxiv-2024-k27ps-v2
    Type Preprint
    Author Heid E
  • 2024
    Title Spatially resolved uncertainties for machine learning potentials
    DOI 10.26434/chemrxiv-2024-k27ps
    Type Preprint
    Author Heid E
  • 2024
    Title A Design Concept Towards Water-Stable Cu-Based MOFs for Efficient Nitrate Adsorption
    DOI 10.26434/chemrxiv-2024-z9pvs
    Type Preprint
    Author Naghdi S
  • 2024
    Title Sum frequency generation (SFG) spectroscopy at surfaces and interfaces: Adsorbate structure and molecular bond orientation
    DOI 10.1016/j.surfrep.2024.100645
    Type Journal Article
    Author Li X
    Journal Surface Science Reports
  • 2024
    Title Strain fingerprinting of exciton valley character in 2D semiconductors.
    DOI 10.1038/s41467-024-51195-y
    Type Journal Article
    Author Kumar Am
    Journal Nature communications
    Pages 7546
  • 2024
    Title Dissociation Energies via Embedding Techniques.
    DOI 10.1021/acs.jpca.4c02851
    Type Journal Article
    Author Feyersinger F
    Journal The journal of physical chemistry. A
    Pages 9275-9286
  • 2024
    Title Enhanced photochemical effects of plasmonic cluster catalysts through aggregated nanostructures
    DOI 10.1039/d4gc00560k
    Type Journal Article
    Author Hu X
    Journal Green Chemistry
  • 2024
    Title Harnessing a Ti-based MOF for selective adsorption and visible-light-driven water remediation.
    DOI 10.1039/d4ta01967a
    Type Journal Article
    Author Myakala Sn
    Journal Journal of materials chemistry. A
    Pages 19924-19934
  • 2024
    Title Bulk-independent surface oxide composition controls the electrochemical performance of high-entropy alloys.
    DOI 10.1039/d4ta03619k
    Type Journal Article
    Author Kogler M
    Journal Journal of materials chemistry. A
    Pages 22565-22575
  • 2024
    Title How reduction temperature influences the structure of perovskite-oxide catalysts during the dry reforming of methane.
    DOI 10.1039/d4su00483c
    Type Journal Article
    Author Schrenk F
    Journal RSC sustainability
    Pages 3334-3344
  • 2024
    Title Bimetallic CuPd nanoparticles supported on ZnO or graphene for CO2 and CO conversion to methane and methanol.
    DOI 10.1039/d4su00339j
    Type Journal Article
    Author Maqbool Q
    Journal RSC sustainability
    Pages 3276-3288
  • 2024
    Title Ligand engineering enhances (photo) electrocatalytic activity and stability of zeolitic imidazolate frameworks via in-situ surface reconstruction.
    DOI 10.1038/s41467-024-53385-0
    Type Journal Article
    Author Huang Z
    Journal Nature communications
    Pages 9393
Patents
  • 2025 Patent Id: AT528030
    Title Sauerstoffionenbatterie
    Type Patent / Patent application
    patentId AT528030
    Website Link
Policies
  • 2006
    Title Member of the Austrian Academy of Sciences Committee for the decarboniczation of the European Energy system
    Type Contribution to a national consultation/review
Disseminations
  • 2024
    Title Member of the Austrian Academy of Sciences Committee for the decarboniczation of the European Energy system
    Type A formal working group, expert panel or dialogue
  • 2024
    Title Panel Discussion at the Energy storage panel at Verbund & xista Venture Day
    Type A formal working group, expert panel or dialogue
  • 2026
    Title TV interview
    Type A broadcast e.g. TV/radio/film/podcast (other than news/press)
  • 2026
    Title talk at the meeting of the Association of Industrials of Lower Austria
    Type A talk or presentation
  • 2026
    Title Instagram account of the physics faculty
    Type Engagement focused website, blog or social media channel
  • 2025
    Title Exhibition "More than recycling" at Technsiches Museum Wien
    Type Participation in an open day or visit at my research institution
  • 2025
    Title press release about the nature paper
    Type A press release, press conference or response to a media enquiry/interview
  • 2025
    Title poster at conference
    Type A talk or presentation
  • 2026
    Title Presentation at the Roadshow of the Young Academy of the Austrian Academy of Sciences
    Type A talk or presentation
  • 2026
    Title visit of chemistry teachers
    Type Participation in an open day or visit at my research institution
  • 2026
    Title Pop-up Science (Kultursommer)
    Type Participation in an open day or visit at my research institution
  • 2026
    Title Student visit from Utrecht Uni
    Type Participation in an open day or visit at my research institution
  • 2025
    Title Conference talk
    Type A talk or presentation
  • 2025
    Title Renewable Energy Carriers 2.0" - Technology Transfer to Industry and AI in Materials Discovery
    Type Participation in an activity, workshop or similar
  • 2026
    Title Wie werden Batterien nachhaltig?
    Type Participation in an open day or visit at my research institution
  • 2026
    Title Organized school visits at the TU Wien via head of physics outreach
    Type Participation in an activity, workshop or similar
  • 2026
    Title Lange Nacht der Forschung 2026
    Type Participation in an open day or visit at my research institution
  • 2024
    Title Tag der Offenen Tür - TU Wien
    Type Participation in an open day or visit at my research institution
  • 2025
    Title MECS Topics and Activities presented at "Wing Forum 2025" (Verband der Wirtschaftsingenieure.
    Type A talk or presentation
Scientific Awards
  • 2026
    Title 1st Place in our Green Inventor of the Year Call 2025
    Type Research prize
    Level of Recognition National (any country)
  • 2026
    Title Mechanistic Understanding of Surface Modifications for Optimizing Oxygen Exchange at SOC Electrodes
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title VASP Young Investigators Award
    Type Poster/abstract prize
    Level of Recognition National (any country)
  • 2026
    Title Invited keynote / plenary
    Type Personally asked as a key note speaker to a conference
    Level of Recognition National (any country)
  • 2026
    Title Plenary talk "Surface Chemistry at the Atomic Scale"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Decoupling Electronic and Ionic Defect Properties in mixed conducting oxides
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title From space charge potentials to battery voltages
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Unifying perspectives on perovskite oxides: From PZT and STO to LSF and LSM
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Decoupling electronic and ionic properties of mixed conducting oxides
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Conference Summary Talk
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Invited Keynote at 19th International Conference on Similarity Search and Applications, SISAP 2026
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title Quantum Matter Distinguished Lecture Series, 2026
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title CHESS26 Bari Poster Award
    Type Poster/abstract prize
    Level of Recognition Continental/International
  • 2026
    Title Symposium on microscopic characterization of the solid/liquid interface - Speakers
    Type Personally asked as a key note speaker to a conference
    Level of Recognition National (any country)
  • 2026
    Title Keynote talk "Fundamentals of STM and AFM"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2026
    Title ISTA Outstanding PhD Award
    Type Medal
    Level of Recognition National (any country)
  • 2026
    Title Best poster award, Solid State Ionics
    Type Poster/abstract prize
    Level of Recognition Continental/International
  • 2026
    Title Silver Medal of the Young Chemists' Award, PhD level
    Type Research prize
    Level of Recognition National (any country)
  • 2026
    Title Best Poster Award, E-MRS Spring Meeting 2025
    Type Poster/abstract prize
    Level of Recognition Continental/International
  • 2026
    Title 7th FemChem Scientific Workshop 2026 - From Breakdown to Breakthrough
    Type Poster/abstract prize
    Level of Recognition National (any country)
  • 2025
    Title FemChem Travelgrant
    Type Research prize
    Level of Recognition National (any country)
  • 2025
    Title Best Talk Award
    Type Research prize
    Level of Recognition National (any country)
  • 2025
    Title Keynote talk "Anatase, Annabella, and I: A personal review of TiO2 surface science"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Plenary talk "Atomically-resolved Surfaces: Where Theory and Experiments Meet"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Fundamental design principles for fast oxygen exchange: Surface and bulk properties of MIEC oxides
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Atomic-scale effects of surface modifications on mixed ionic and electronic conducting oxides
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title TU Mobility grant
    Type Research prize
    Level of Recognition National (any country)
  • 2025
    Title 8th International Conference on Ionic Liquid-Based Materials - ILMAT 2025
    Type Poster/abstract prize
    Level of Recognition Continental/International
  • 2025
    Title Keynote talk "Non-contact Atomic Force Microscopy: The Ideal Tool for Investigating Insulating Oxides"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Electronic and ionic contributions to space charges in mixed conducting oxides: connecting experiment and theory
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Lithium ion battery cathode materials meet oxide ion conductors
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title Keynote talk "Atomically-resolved surface structure - the prerequisite for understanding surface chemistry"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title TU KuWi grant
    Type Research prize
    Level of Recognition National (any country)
  • 2025
    Title Invited keynote / plenary
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2025
    Title 8th International Conference on Ionic Liquid-Based Materials - ILMAT 2025
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2024
    Title The chemical capacitance as the link between defect chemistry and electrode potentials in lithium ion and oxygen ion batteries
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2024
    Title Best Teaching Awards 2024
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title Theodor Körner Preis 2024
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title GÖCH Reisestipendium
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title FemChem Travelgrant
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title "The chemical capacitance as the link between defect chemistry and electrode potentials in lithium ion and oxygen ion batteries Lithium ion battery cathode materials meet oxide ion conductors"
    Type Personally asked as a key note speaker to a conference
    Level of Recognition Continental/International
  • 2024
    Title ACS Nano Best Oral Presentation Award
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title Hans Thirring Prize 2023/24
    Type Research prize
    Level of Recognition National (any country)
  • 2024
    Title TU Mobility grant
    Type Research prize
    Level of Recognition National (any country)
  • 2023
    Title Fellow of the European Academy of Sciences (EurASc)
    Type Awarded honorary membership, or a fellowship, of a learned society
    Level of Recognition Continental/International
Fundings
  • 2023
    Title TU-DX: Towards Applications of 2D Materials
    Type Research grant (including intramural programme)
    Start of Funding 2023
    Funder Austrian Science Fund (FWF)
  • 2026
    Title Recycling Industrial CO2 to Carbonates via Solar-Driven Photoreactors Based on 3D-Printed Catalyst
    Type Research grant (including intramural programme)
    Start of Funding 2026
    Funder Austrian Research Promotion Agency
  • 2024
    Title Substrate-decoupled 2D MOF for Single-Atom Catalysis
    Type Research grant (including intramural programme)
    Start of Funding 2024
    Funder Austrian Science Fund (FWF)
  • 2023
    Title Direct Carbon Capture and Electrolysis
    Type Research grant (including intramural programme)
    Start of Funding 2023
    Funder Austrian Research Promotion Agency
  • 2025
    Title Christian Doppler Laboratory for Oxygen Ion Batteries
    Type Research grant (including intramural programme)
    Start of Funding 2025
    Funder Christian Doppler Research Association
  • 2025
    Title Oxygen exchange on modified oxide surfaces
    Type Research grant (including intramural programme)
    DOI 10.55776/pat5485224
    Start of Funding 2025
    Funder Austrian Science Fund (FWF)
  • 2024
    Title CoE Fellowship
    Type Fellowship
    Start of Funding 2024
    Funder Institute of Science and Technology Austria
  • 2026
    Title Tracking down the mechanism of the oxygen exchange reaction
    Type Research grant (including intramural programme)
    DOI 10.55776/esp4504825
    Start of Funding 2026
    Funder Austrian Science Fund (FWF)
  • 2024
    Title Advances in Single-Atom-Polaron Catalysis
    Type Research grant (including intramural programme)
    Start of Funding 2024
    Funder Austrian Science Fund (FWF)
  • 2026
    Title TU Bridge Doctoral network
    Type Research grant (including intramural programme)
    Start of Funding 2026
    Funder Vienna University of Technology
  • 2024
    Title Photo-electro integrated next-generation energy technologies
    Type Research grant (including intramural programme)
    Start of Funding 2024
    Funder European Commission
  • 2027
    Title ERC proof of Concept Grant
    Type Research grant (including intramural programme)
    Start of Funding 2027
    Funder European Resuscitation Council
  • 2024
    Title Deep learning of chemical reactions
    Type Research grant (including intramural programme)
    Start of Funding 2024
    Funder Austrian Science Fund (FWF)
  • 2026
    Title 1st Place in our Green Inventor of the Year Call 2025
    Type Travel/small personal
    Start of Funding 2026
    Funder University of Vienna

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