Big thanks to the @pccp.rsc.org Editorial Board for selecting our recent article on spin-orbit coupling in multireference coupled-cluster theory (doi.org/10.1039/D5CP...) for the 2025 HOT PCCP articles list. We appreciate the distinction.

@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!

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!

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...

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!

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

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

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

I have an open PhD position on the development of coupled cluster models for electronically open molecules🌟 Please share! #ERCCoG

www.jobbnorge.no/en/available...

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

The Spin-Phonon Relaxation Mechanism of Single-Molecule Magnets in the Presence of Strong Exchange Coupling

Out in ACS Central Science @acs.org

In collaboration with @koehngroup.bsky.social @agvsl.bsky.social & Sarkar

pubs.acs.org/doi/10.1021/...

David's, Julia's and Simon's excellent work on the electronic structure of a radical-bridged dinuclear single-molecule magnet has now been published in @naturecomms.bsky.social. rdcu.be/ecfil. Coll. @koehngroup.bsky.social and Biprajit Sarkar. @unistuttgart.bsky.social. @dfg.de. @mwk-bw.bsky.social

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...

👋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...

... and they do really well 😀

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

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

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:

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

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...

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