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Photoinduced Isomerization of [N2]2– in a Bimetallic Lutetium Complex | Journal of the American Chemical Society Los Alamos National Laboratory #Photoinduced #Isomerization #Bimetallic #Lu #Complex pubs.acs.org/doi/10.1021/ja…

Back again with spin-phonon coupling in a molecular magnet! 🧲

Just published in Inorganic Chemistry: Trigonal planar lanthanide(III) bis(silyl)amide aminoxyl complexes reported by University of Manchester teams: go.acs.org/bDz @uomchemistry @chemistryuom @gemgransbury @hannahchemistry @conradgoodwin Prof. Nicholas F Chilton Dr Marcus Giansiracusa MillsGroup

In our latest work published in Angewandte Chemie we exploited the high order anisotropy of a lanthanide complex to engineer a new class of magnetic refrigerators! Cool collab between Italy, Poland and Denmark! onlinelibrary.wiley.com/doi/full/10.10… Leonardo Tacconi European Research Council (ERC) Association of ERC Grantees

Our high-throughput study of 15k Co complexes in search of record-large zero field splittings is out in J. Am. Chem. Soc. pubs.acs.org/doi/10.1021/ja… Excellent work of Lorenzo Mariano together with Annie Nguyen Valerio Briganti European Research Council (ERC) TCD_physics AMBER cranntcd

Role of Electron Correlation beyond the Active Space in Achieving Quantitative Predictions of Spin-Phonon Relaxation Out in JCIM & JCTC Journals today 🥳 Excellent work of Soumi Haldar from Gagliardi Group and our own Lorenzo Mariano European Research Council (ERC) TCD_physics pubs.acs.org/doi/10.1021/ac…

New work out by Sabyasachi Roy Chowdhury and undergrad co-author Naomi Rehberg! Continuing our interest in actinide-arene and borohydride bonds. pubs.acs.org/doi/10.1021/ac…

Double-Decker Ferrocene Analogue Derived from Flexible 14π Triphyrin(2.1.1) along with an Unusual Diels–Alder Adduct: Synthesis, Characterization, and Mechanistic Studies pubs.acs.org/doi/10.1021/ac… Sharma, Panda, and co-workers Inorganic Chemistry #iron #14pi #triphyrin #Fc #MD

Have a look at this recently published paper! Former postdoc Soumi Haldar studied single-molecule magnets with post-CASSCF methods to predict the spin-phonon relaxation time. JCIM & JCTC Journals UChicago Chemistry pubs.acs.org/doi/full/10.10…

s-Block Metal-Lanthanide Bonding: Direct Comparison of Mg–Yb and Mg–Ca Complexes | Journal of the American Chemical Society VUB FAU Erlangen-Nbg pubs.acs.org/doi/10.1021/ja…

High valent lanthanide, inverted ligand field and associated challenges..What a fun project to work on! Many thanks to Bess Vlaisavljevich, team La Pierre Group and Popov Computational Lab for this wonderful collaboration.

☄️ Just out as preprint: Generating new coordination compounds via mutlireference simulations, genetic algorithms and machine learning: the case of Co(II) molecularnmagnets. arxiv.org/abs/2504.13749 Great work by Lion Zahra Khatibi and Lorenzo Mariano European Research Council (ERC)

@AKRoesky disclosed a new reaction pathway, in which for the first time a lanthanide half-sandwich unit inserts into an existing sandwich complex. As result a triple decker complex is formed. #openaccess 🔓 onlinelibrary.wiley.com/doi/10.1002/an…

In their latest work, Eric J. Schelter and his colleagues have shown that 4f orbitals can play an essential role in guiding the reaction of a molecule attached to a lanthanide. cen.acs.org/materials/inor…

Excited to present our latest study on two new terbium complexes supported by bulky bis(amide) ligands 😊😎🥳🎉! One constitutes a formally divalent terbium complex with single-molecule magnet behavior 🧲! Published in Inorganic Chemistry! pubs.acs.org/doi/10.1021/ac… Demir Group MSU Chemistry

Have you ever seen a Single Molecule Magnet on the surface kidnapping lithium ions as a UFO? Me neither... Before this work! Finally out on Science Advances a great collaboration between Università di Firenze and Universität Konstanz: science.org/doi/10.1126/sc…

Twenty case studies showing theoretical predictions in chemistry that were later confirmed experimentally. #CompChem doi.org/10.1515/pac-20…

#OnTheCover A Novel Synthetic Pathway to Lanthanide Triple-Decker Complexes: Selective Expansion of a Sandwich Complex by an Insertion Reaction (Peter W. Roesky and co-workers) onlinelibrary.wiley.com/doi/10.1002/an… @AKRoesky • onlinelibrary.wiley.com/doi/10.1002/an…

Just published in Inorganic Chemistry ACS Publications Spin Coherence and Electron Spin Distribution of a Silver(II) S = 1/2 Molecular System. Thank you to all the collaborators and special congrats to first author Joan Serra Castelló IN2UB Facultat de Química UB pubs.acs.org/doi/10.1021/ac…