I have an opening for a postdoc in computational photochemistry to study inverted singlet-triplet molecules as solar fuel photocatalysts. To see the details and apply, go to: dtu.dk/english/about/… Deadline: 30th Nov #compchem

Degradation of Quinone-based Flow Battery Electrolytes: Effect of Functional Groups on the Reaction Mechanism (Silva) Piotr de Silva DTU Energy onlinelibrary.wiley.com/doi/10.1002/ba…

Our new manuscript is now on ChemRxiv! Anion-responsive colorimetric and fluorometric red-shift in a triarylborane derivative has been realized by dual role of phenazaborine as Lewis acid and electron donor. doi.org/10.26434/chemr…

I have an opening for a postdoc and PhD student (starting in 2024): - Postdoc in TD-DFT development bit.ly/dtu_postdoc - PhD student in computational molecular photophysics bit.ly/dtu_PhD Apply by 24 Sep 2023. Retweets appreciated. #compchem #PhDposition #postdoc

Our own Laure de Thieulloy presenting her work on the photophysics of inverted singlet-triplet gap molecules at the Optical Probes conference in the beautifully decorated Sala Bianca in Como, Italy!

Vibrations and solvent polarity can make a big difference in the photophysics of a molecule. With the framework we developed, the calculation of photophysical properties from molecular structures is streamlined and analysis is made easy with an interactive dashboard. #compchem

#TeamCAPeX and DTU Energy are looking for two exceptional postdoc fellows and #Power2Xperts. Be part of developing a unique decentralised self-driving lab in the Danmarks Grundforskningsfond Pioneer Center CAPeX and University of Toronto Acceleration Consortium (AC) & Utrecht University. Please repost! efzu.fa.em2.oraclecloud.com/hcmUI/Candidat…

I have an opening for a postdoc to work on TD-DFT development. Details and application: bit.ly/postdoc_DTU Application deadline: 31 Jan 2024. RT appreciated #compchem

We have figured out a way to design more non-alternant hydrocarbons with inverted excited-state singlet triplet gaps. Online as open access communication in Chemical Communications doi.org/10.1039/D3CC05… clemence corminboeuf Carlsbergfondet

Thrilled to announce our latest research on anion-responsive red-shifting triarylboranes has just been published in Angewandte Chemie ! doi.org/10.1002/anie.2… Congratulations, Nae and Riku! International collaboration with Leonardo Sousa and Piotr de Silva

Anion-Responsive Colorimetric and Fluorometric Red-Shift in Triarylborane Derivatives: Dual Role of Phenazaborine as Lewis Acid and Electron Donor (Youhei Takeda and co-workers) Youhei Takeda Piotr de Silva Leonardo Sousa 大阪大学 The University of Osaka #OpenAccess onlinelibrary.wiley.com/doi/10.1002/an…

Nuclear ensemble simulations show that solvent can change reverse intersystem crossing rates by orders of magnitude and determine the thermally activated delayed fluorescence (TADF) mechanism in a carbene-copper emitter Laure de Thieulloy Leonardo Sousa Piotr de Silva go.acs.org/aVw

Our new paper on the #TADF properties of dibenzophenazine-cored phenazaborines has been out The Journal of Physical Chemistry C! EL colors are tunable with fluoride. It is collaborative work with Przemyslaw Data, Leonardo Sousa , and Piotr de Silva 🇯🇵🇵🇱🇩🇰 ! bit.ly/3XT7B6H

I'm hiring two PhD students in atomic-scale modelling of organic flow battery materials. The positions are within an EU-funded MSCA Doctoral Network PREDICTOR. Application deadline: 8 November 2024. Details at efzu.fa.em2.oraclecloud.com/hcmUI/Candidat…

It's been a while since my paper on singlet-triplet inversion. Now we have something more to say about it. Check the preprint: chemrxiv.org/engage/chemrxi…

Now published in J. Mater. Chem. C as part of a themed collection on “Perspective on the technologies of OLEDs”. pubs.rsc.org/en/Content/Art…