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Taming Complexity together

 

UPCOMING COLLOQUIUM: May 12th — Operando Surface Chemistry on Copper Oxides by Dario J. Stacchiola
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Category: Publication Highlight

6 Jul 23 taco-admin

Imaging Interface and Particle Size Effects by In Situ Correlative Microscopy of a Catalytic Reaction

Published in ACS Catalysis and was featured on the cover.
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0
9 Mar 23 taco-admin

Combining Machine Learning and Many-Body Calculations: Coverage-Dependent Adsorption of CO on Rh(111)

Published in Physical Review Letters
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22 Aug 22 taco-admin

Surface chemistry on a polarizable surface: Coupling of CO with KTaO3(001)

Published in Science Advances
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0
1 Aug 22 taco-admin

Competing electronic states emerging on polar surfaces

Published in nature communications
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0
9 Jun 22 taco-admin

Machine learning for exploring small polaron configurational space

Published in npj computational materials
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0
29 Apr 22 taco-admin

Structure of an Ultrathin Oxide on Pt3Sn(111) Solved by Machine Learning Enhanced Global Optimization

Accepted in Angewandte Chemie and ranked in the top 10 % of articles.
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0
4 Apr 22 taco-admin

CO oxidation by Pt2/Fe3O4: Metastable dimer and support configurations facilitate lattice oxygen extraction

Published in Science Advances and featured as TU Wien press release on April 4th 2022.
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0
23 Feb 22 taco-admin

Reconstruction changes drive surface diffusion and determine the flatness of oxide surfaces

Published in Journal of Vaccum Science & Technology A and featured as AIP Scilight in February 2022.
Publication Highlight
0

Recent Posts

  • Uncovering active sites in heterogeneous catalysts using operando X-ray absorption spectroscopy
  • Operando Surface Chemistry on Copper Oxides
  • From Interfaces to Interphases: Revealing Complexities of Multi-Component Systems by In-Situ Force and Optical Microscopies
  • Metal-CeO2 Interfaces and their Role in Methane Conversion to Fuels
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    • Home
    • About...
      • ... TACO
      • ... SFBs
    • Consortium
      • Consortium
      • Project Coordination (P01)
      • Atomic structure & reactivity (P02)
      • Machine-learned potentials (P03)
      • Atomic-scale catalysis (P04)
      • Polarons, Computer vision & ML (P07)
      • Surface catalysis (P08)
      • Structure prediction (P09)
      • Nanocatalysis at work (P10)
      • Liquid/oxide interfaces (P11)
      • Rare events & neural networks (P12)
      • Chemical Accuracy for Complex Oxides (Affiliated)
    • News
    • Events
    • Publications
      • Publications
      • Highlights
      • Conference Contributions
      • Newsletters
    • Members
    • Information...
      • ... for Students
      • ... about Open Positions
    • Downloads
    • Home
    • About…
      • … TACO
      • … SFBs
    • Consortium
      • Consortium
      • Project Coordination (P01)
      • Atomic structure & reactivity (P02)
      • Machine-learned potentials (P03)
      • Atomic-scale catalysis (P04)
      • Polarons, Computer vision & ML (P07)
      • Surface catalysis (P08)
      • Structure prediction (P09)
      • Nanocatalysis at work (P10)
      • Liquid/oxide interfaces (P11)
      • Rare events & neural networks (P12)
      • Chemical Accuracy for Complex Oxides (Affiliated)
    • News
    • Events
    • Publications
      • Publications
      • Highlights
      • Conference Contributions
      • Newsletters
    • Members
    • Information…
      • … for Students
      • … about Open Positions
    • Downloads