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QC Seminar

Seminar on Quantum Chemistry

(LV-Nr 21391a)

Please note that due to the coronavirus outbreak, no seminars will be given at the university during the summer term 2021. Instead, online group seminars will be held via Webex. Links are given below.

The weekly online seminar will be held Tuesdays starting at 14:15.





Johannes Hannemann, Robert Burda

Quantum chemical calculations for structural properties of anionic nickel fluoride complexes  (research internship report),

First principle calculations for crystal structure prediction of chlorido-lithates (research internship report)

16.09 Dilara Balci

Theoretische Untersuchungen von Mono- und Lindqvist Hexaniobaten (Bachelor defence)


 Hanh Dung Nguyen

Simulations of reaction dynamics and spectroscopy of the H3 collision complex (Bachelor defence)


Jakob Hein

Relativity in Quantum Chemical Calculations on p-Block Element Compounds (master thesis mid term report) 

07.10 (Thu) 14:00

 Mahmoud Ibrahim

Theoretische Untersuchungen des Lösungsmitteleinflusses auf die Säuredissoziation bei Phenolderivaten (BA Verteidigung in deutsch)


Fridolin Fiechter

Computational Approaches to electrochemical N2 reduction reactions (literature seminar)

26.10 Jakob Hein Essentials of relativistic quantum chemistry (literature seminar)

Nianci Zhang, Raeed Almerei

First principle investigation of the vibrational spectrum of OH-functionalized boronnitride, Investigating the photochemical properties of an arylazo-pyrazole photoswitchable rotaxane (two research internship)

Hendrik Wiedenhaupt

First principle investigation of adsorption of HF and H2O on stable HoF3 surfaces.  (research internship)

Paul Albrecht

Angle-resolved photoelectron-spectroscopy with a time-dependent CI method (master defence)

Occurs every Tuesday effective 4/28/2020 from 2:15 PM to 4:15 PM, (UTC+02:00) Amsterdam, Berlin, Bern, Rome, Stockholm, Vienna Meeting number: 240 692 301 Password: mwAEn38HpJ7 https://fu-berlin.webex.com/fu-berlin-en/j.php?MTID=m980e93dc81cfa2397334156320cde680 Join by video system Dial 240692301@fu-berlin.webex.com You can also dial and enter your meeting number. Join by phone +49-69-2551-14400 Germany Toll 2 +49-619-6781-9736 Germany Toll Access code: 240 692 301