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[2410.03620] Time-Reversal Symmetry in RDMFT and pCCD with Complex-Valued Orbitals #compchem arxiv.org/abs/2410.03620

Thanks Edu for hosting Lexin! I hope you two made good progress with both the social and the covalent bonding projects 😉

Hot off the press Munich Center for Quantum Science and Technology Munich Quantum Valley Universität München pubs.rsc.org/en/content/art…

Want to calculate excited states variationally? Check out our latest article, where we complete and rationalize the ensemble variational principle by Gross, Oliveira and Kohn!: Munich Center for Quantum Science and Technology Universität München Munich Quantum Valley quantum-journal.org/papers/q-2024-…

Postdoc positions available at LMU Munich in a vibrant research environment with exciting projects in Quantum Information Theory, Quantum Chemistry and Quantum Computing Munich Center for Quantum Science and Technology Munich Quantum Valley Universität München Please RT! theorie.physik.uni-muenchen.de/lsschollwoeck/…

Did you know the Pauli exclusion principle can be extended? 🚀 In our latest preprint, we derive universal constraints on fermionic occupation numbers that account for spin symmetry & entropic mixedness Curious? Dive in: Munich Center for Quantum Science and Technology Universität München arxiv.org/abs/2412.01805

Thrilled to share with you that my first PhD student at Universität München Munich Center for Quantum Science and Technology , Lexin Ding, has been awarded a prestigious ETH Postdoctoral Fellowship! Huge congratulations and best of luck, Lexin, as you embark on this exciting next chapter of your career!

PhD/PostDoc in Quantum Computing for Quantum. Have a look if you want to develop quantum computing approaches to enable accurate quantum chemistry: dobrautz.github.io/jobs/ Sharing and endorsing would be greatly appreciated <3 Center for Advanced Systems Understanding at HZDR HZDR @[email protected] BMBF Quantentechnologien

🚨 New preprint! 🚨 with Lexin Ding & Eduard Matito 🎗 Munich Center for Quantum Science and Technology Universität München From Entanglement to Bonds: Chemical Bonding Concepts from Quantum Information Theory MEAOs unify Lewis & beyond-Lewis structures via entanglement. 📄 Read here: arxiv.org/abs/2501.15699

Thrilled to unveil our new arXiv preprint! 🚀 Building on Klyachko's seminal extension of Pauli’s exclusion principle, we establish a toolbox for applying spin-adapted generalized Pauli constraints. Dive in and share your thoughts! Munich Center for Quantum Science and Technology arxiv.org/abs/2502.15464

Thrilled by Julia Liebert's amazing talk at IPAM on the legacy of our work in reduced density matrices, functional theories, & electron correlation. Check out the insights shaping the future of #science! 👇 youtube.com/watch?v=Z8yg_g… #Research #Physics #Innovation #FutureOfScience

🚨Transfer news from the Schilling Group⚽ We’re really excited to welcome Markus Penz as our new Senior Researcher! He brings top tier skills in functional theories and electronic structure theory🧙‍♂️🧪 #QuantumChemistry #NewSigning

We are currently looking for a postdoc. If you are intrigued by Singapore and CQT (and you should be) and have experience in mathematical aspects of quantum information, especially with information measures, quantum cryptography or learning theory, get in touch!

New preprint with my student Julia Liebert & David Mazziotti! We develop a spin-adapted framework for RDM cumulants -- size-extensive, symmetry-aware, and applicable to DFT, RDMFT & 2-RDM methods. arxiv.org/abs/2505.16989 #QuantumChemistry #SpinSymmetry #RDMFT

Huge congrats to my PhD student Dr. Julia Liebert on defending her thesis with summa cum laude at LMU Munich! 🎓 300+ pages, 500+ refs, 15 papers — using quantum information to deepen and generalize functional theory, incl. symmetries & correlation. Onward! 🚀 #PhDDefense

🚨 New preprint! Excited to share the latest work of the Schilling (LMU) and Mazziotti (UChicago) groups on refining ensemble N-representability based on partial information. Connections to Horn’s problem + new convex constraints! 📄 arxiv.org/abs/2506.09960

🎉 Our work on spin-adapted generalized Pauli constraints is now published in Phys. Rev. Research! We extend GPCs to larger systems using spin symmetry—opening new paths in wave function & density matrix theory. 📄journals.aps.org/prresearch/abs…

It was a wonderful and inspiring event. I’m really grateful for the opportunity to speak and to engage with so many dedicated colleagues from across the community. Many thanks to the organizers and all participants for the stimulating discussions and warm atmosphere!