iiinova — where your digital self keeps evolving

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 18/06/2026

Thanks for the perfect collaboration. Looking forward to continue on this!

010

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 02/03/2026

Hurray, one more PhD! 😀 Congratulations to Julia!

Julia proudly wearing wearing the doctoral cap, fondly handcrafted by her colleagues (not those on the picture, that is the examination committee).

010

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 10/11/2025

A new PhD (actually a doctor rerum naturalis) is born! Congratulations, Patrik! 👨‍🎓🎉

The candidate (2nd from the right, still a bit exhausted) after the rigorosum, surrounded by the examiners.

020

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 26/06/2025

@unistuttgart.bsky.social is presented at WATOC2025 in Oslo by @johanneskaestner.bsky.social group, Benjamin Stamm's group, Guntram Rauhut's group, and us. A very enjoyable meeting!

A group picture of (nearly) all University of Stuttgart participants.

010

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 28/05/2025

We have now released Version 1.1.1 of chARpack (chemistry in Augmented Reality package). This includes precompiled binaries for Windows (Server App), Android (Client App on Quest 3), or Universal Windows (Client App on Hololens 2). Find it on github.com/KoehnLab/chA... and have some real 3D fun!

Scene showcasing the program package: An interactive hologram representation of a molecule in front of a computer screen.

010

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 08/05/2025

Now online (and open access): Our (personal) perspective on multireference coupled-cluster theory (with Robert Adam and Alex Waigum): See doi.org/10.1002/wcms...

The graphical abstract published with that work. It shows the coupled-cluster exponential ansatz sailing from "the safe shores of single reference theory" to the "promised land of high-accuracy multireference theory" (the "cliffs of complexity" still to be by-passed). Maybe a bit silly, but we had to draw something :)

011

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 02/05/2025

Tobias Rau has now presented his paper #CHI2025 and also received the paper award. If you look closely at the picture you see that also molecules are involved. Nice collaboration with @tisenberg.bsky.social and Michael Sedlmair and Benjamin Lee from VISUS @unistuttgart.bsky.social. Well done Tobias!

Picture showing Tobias during his presentation at the CHI2025. The title slide is shown in the background: "Traversing Dual Realities: Investigating Techniques for Transitioning 3D Objects between Desktop and Augmented Reality Environments". There is also a picture on the title slide showing a user who "pulls" a molecule "out of the screen" into a 3D hologram representation. (That's the connection to chemistry, if you wonder.)

020

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 23/04/2025

Now online in Advanced Optical Materials: Nice work of the group of A. J. C. Kuehne (Ulm), in collaboration with @deschlerlab.bsky.social, A. Gross and our group (featuring Robert Toews). A new twist on radical emitters, so to say 🙂. Check it out at doi.org/10.1002/adom... @unistuttgart.bsky.social

Table of contents graphic showing the relevant chemical structures of donor substituted trityl radicals. Additional Chlorine substituents at the trityl site increase the donor-acceptor angle and lead to larger quantum yields (increase from 4-27% to 16-59%).

062

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 17/04/2025

... and after Easter, Tobias Rau from our group will fly to Japan to present the newest outcome from our collaboration:

030

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 17/04/2025

There are some updates from our collaboration with @tisenberg.bsky.social and the team at VISUS @unistuttgart.bsky.social. This is a slightly older post by Tobias on a collaborative learning evironment based on our chARpack software, see also charpack.github.io

040

Reposted by Koehn group (theoretical chemistry)

agtheochem.bsky.social @agtheochem.bsky.social · 17/03/2025

The AgTC (Arbeitsgemeinschaft Theoretische Chemie) is joining the blue sky. We will post about theoretical and computational chemistry-related topics. To find out more about us, visit agtc.univie.ac.at #AgTC #TheoChem #CompChem

agtc.univie.ac.at

ARBEITSGEMEINSCHAFT THEORETISCHE CHEMIE

0214

Reposted by Koehn group (theoretical chemistry)

4th European Conference on Molecular Spintronics @ecmols2025.bsky.social · 12/02/2025

The 4th European Conference on Molecular Spintronics is coming to Dublin this year! Join us from the 2nd to the 4th of June @tcddublin.bsky.social #TCDSchoolOfPhysics 🧲⚛️🖥️ Follow us for news or click on the webpage below to see the programme and travel info! www.linkedin.com/events/ecmol...

linkedin.com

ECMolS 2025 Conference | LinkedIn

This is the official LinkedIn event page of the 4th European Conference on Molecular Spintronics (ECMolS 2025) to be held from 2nd to 4th June, 2025 at Trinity College Dublin, Ireland. Following the ...

133

Reposted by Koehn group (theoretical chemistry)

Kasper S. Pedersen @kasperspedersen.bsky.social · 07/02/2025

👋Our department at the Technical University of Denmark is looking for an assistant/associate professor in *any* chemical discipline! 🧪🇩🇰 Check it out and feel free to get in touch 💬 👇 efzu.fa.em2.oraclecloud.com/hcmUI/Candid...

efzu.fa.em2.oraclecloud.com

Associate Professor or DTU Tenure Track Assistant Professor in Chemistry - DTU Chemistry

The Technical University of Denmark (DTU) offers the opportunity to build a research group in advanced and applied chemistry at an internationally esteemed department with an excellent infrastructure.

11515

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 28/01/2025

Today's group seminar program: Classical mechanics (practical exercise 🙂)

130

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 23/01/2025

Our new paper on multireference CC/CEPA hybrids is now out: doi.org/10.1002/jcc....

030

Reposted by Koehn group (theoretical chemistry)

Amrei Bahr @amreibahr.bsky.social · 10/01/2025

Starkes Signal!! Über 60 dt. Hochschulen & Forschungsinstitutionen haben heute ihren Ausstieg bei X bekanntgegeben, s.u. #eXit X sei nicht mehr vereinbar mit ihren Grundwerten: „Weltoffenheit, wissenschaftliche Integrität, Transparenz und demokratischer Diskurs.“ Liste der Beteiligten hier:

nachrichten.idw-online.de

Hochschulen und Forschungsinstitutionen verlassen Plattform X - Gemeinsam für Vielfalt, Freiheit und Wissenschaft

883377825

Reposted by Koehn group (theoretical chemistry)

Johannes Kästner @johanneskaestner.bsky.social · 07/01/2025

Thrilled to host @jwestermayr.bsky.social from uni Leipzig for a talk at our institute today! We look forward to intensive discussions.

061

Reposted by Koehn group (theoretical chemistry)

Sindlinger Lab @sindlinger-lab.bsky.social · 02/01/2025

Hello chemical community here over where the skies are blue! As our first post/tweet here, we would like to make you aware of the approaching closing date (6th Jan 25) for a professorship of coordination chemistry at our institute of inorganic chemistry in Stuttgart! www.nature.com/naturecareer...

nature.com

Professorship (W3) „Inorganic Coordination Chemistry" - Stuttgart, Baden-Württemberg (DE) job with Universität Stuttgart | 12832718

University of Stuttgart Faculty of Chemistry Professorship (W3) „Inorganic Coordination Chemistry” Institute of Inorganic Chemistry | to be appoi...

063

Koehn group (theoretical chemistry) @koehngroup.bsky.social · 01/01/2025

Happy New Year! We just created a new place to be here on this platform. More to come 🙂

041