Humboldt-Universität zu Berlin - Faculty of Mathematics and Natural Sciences - Theoretical Chemistry

Welcome to the Theoretical Chemistry Group

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News

 

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Dezember 2023


  • Congratulations, Eric, on being accepted for the Walter Benjamin Programme of the DFG
    The research project aims at a microscopic understanding of thermal reaction mechanisms and molecular spin properties in polaritonic chemistry. Ab initio electronic structure methods will be developed for closed- and open-shell molecules strongly coupled to low-frequency optical cavities.

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Dezember 2023


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November 2023


    • Welcome to the group, Dr. Eric Fischer.
      Dr. Eric Fischer joins the Quantum Chemistry Group as a guest scientist for four month.

September 2023


      • Presentation Award at the QBIC VI
        Congratulations to Esma on winning the prize for the best oral presentation at the 6th Quantum Bio-Inorganic Chemistry Conference in Warsaw.

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September 2023


      • Good news: Our proposal for a new computer cluster has been accepted by the DFG

August 2023


  • Congratulations, Mihkel, on your paper about spin-adapted heatbath-CI, August 2023.

https://onlinelibrary.wiley.com/doi/full/10.1002/jjc.27203

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September 2023