Publications

Please find the list of publications that have emerged from CRC 1573 "4f for Future" below.

2026

E. Vasilenko, V. Unni Chorakkunnath, J. Resch, N. Jobbitt, D. Serrano, P. Goldner, S. K. Kuppusamy, M. Ruben, D. Hunger
Optically detected nuclear magnetic resonance of coherent spins in a molecular complex
Nat. Mater. 2026, 25, in press, doi:10.1038/s41563-026-02539-0.
X. Sun, A. Hinz, S. Maier, S. Gillhuber, D. Jin, M. Saito, F. Weigend, S. Schlittenhardt, E. Moreno-Pineda, W. Wernsdorfer, M. Ruben, P. W. Roesky
Contrasting single-molecule magnet behaviour in dysprosium and terbium bis(stannolediide) complexes
Nat. Chem. 2026, 18, 872-881, doi:10.1038/s41557-026-02114-9.
Z. Zhu, X. Ying, L. C. Adi, C. Zhao, E. J. M. Chew, L. Ungur, S. Paul, W. Wernsdorfer, C. Train, G. L. J. A. Rikken, M. Atzori, J. Tang
Homochiral toroidal spin state in Dy(III)-based single-molecule toroics
Nat. Chem. 2026, in press, doi:10.1038/s41557-026-02070-4.
L. Baumgärtner, C. Feldmann
Homoleptic complexes of vanadium and N-heterocycles made via oxidation of vanadium nanoparticles
Dalton Trans. 2026, 55, 4856-4866, doi:10.1039/d6dt00230g.
F. Gao, C. Yang, Y. Lyu, L. Zhang, P. Cheng, L. Chen, E.-G. Wang, S. Klyatskaya , C. Zhang, M. Ruben, S. Meng, K. Wu, Y.-Q. Zhang
Anomalous rotational-symmetry breaking in proton arrangement of surface-confined cyclic hydrogen bonds revealed by atomic force spectroscopy
Nat. Commun. 2026, 17, 153, doi:10.1038/s41467-025-66848-9.
J. Arneth, C. Pachl, G. Greif, B. Beier, P. W. Roesky, K. Fink, R. Klingeler Toward Understanding Prolate 4f monomers: Numerical Predictions and Experimental Validation of Electronic Properties and Slow Relaxation in a Muffin-Shaped Er^III Complex
Inorg. Chem. 2026, 65, 3929-3939, doi:10.1021/acs.inorgchem.5c05241.
J. Gutenthaler-Tietze, C. G. Heßler, L. J. Daumann
Inﬂuence of Rare Earth Elements on Prebiotic Reaction Networks Resembling the Biologically Relevant Krebs Cycle
Angew. Chem. Int. Ed. 2026, 65, e16853, doi:10.1002/anie.20251685.
S. M. Gutenthaler-Tietze, M. Mertens, M. Tri Phi, P. Weis, B. Drobot, A. Köhrer, R. Steudtner, U. Karst, N. C. Martinez-Gomez, L. J. Daumann
Comparative Binding Studies of the Chelators Methylolanthanin and Rhodopetrobactin B to Lanthanides and Ferric Iron
ChemBioChem 2026, 27, e202500312, doi:10.1002/cbic.202500312.
H. Chen, A. Borzì, D. Jankovic, J.-G. Hartmann, P.-A. Hervieux
Full- and Low-Rank Exponential Euler Integrators for the Lindblad Equation
SIAM J. Sci. Comput. 2026, 48, A1-A26, doi:10.1137/24M1690795.
Y. Nakajima, P. Weis, F. Weigend, M. Lukanowski, F. Misaizu, M. M. Kappes
A cyclic ion mobility and DFT study of the structures, isomer space and isomer interconversion of lanthanide bromide clusters, Ln_xBr_3x+1⁻, x = 1-6
Phys. Chem. Chem. Phys. 2026, 28, 596-612, doi:10.1039/D5CP03530A.
Z. Jing, E. Moreno-Pineda, S. Paul, A. Sunil, O. Fuhr, Y. Chen, W. Wernsdorfer, M. Ruben
Leveraging 3d-4f Coordination: Molecular Quantum Spring-Magnet Behavior in Axial Ni₂Ln Complexes
Angew. Chem. Int. Ed. 2026, 65, e22076, doi:10.1002/anie.202522076.
M. Lukanowski, F. Weigend
Error-consistent basis sets for large-core ECPs for elements La–Lu
Phys. Chem. Chem. Phys. 2026, in press, doi:10.1039/D5CP04944J.
T. Haas, T. Neumann, N. Jobbitt, X. Yang, H. Schubert, D. Hunger, M. Seitz
Mixed Phenanthroline−Bipyridine Europium and Ytterbium Cryptates − Bright Luminophores with Small Radiative Lifetimes
Inorg. Chem. 2026, in press, doi:10.1021/acs.inorgchem.5c05828.
S. K. Kuppusamy, C. Pachl, Z. Jing, S. Paul, B. Heinrich, O. Fuhr, S. Klyatskaya, W. Wernsdorfer, A. K. Powell, K. Fink, M. Ruben
Ligand-field symmetry and magneto-optical correlations in a luminescent Dy(III) single-molecule magnet
Dalton Trans. 2026, 55, 5448-5465, doi:10.1039/D6DT00081A.
D. Meng, R. Popescu, C. M. Andrei, J. Himbert, E. Madirov, J. A. Branson, E. M. Reynolds, T. Prüßmann, J. Göttlicher, T. Vitova, N. Hildebrandt, Y. Eggeler, B. S. Richards, O. Walter, D. Hudry
Controlled Synthesis of a New Class of Heterostructured Metal Oxides (Cerium, Thorium, Uranium)/Calcium Fluoride Core-Shell Nanocrystals With Atomically Coherent Interfaces
Angew. Chem. Int. Ed. 2026 , 65, e24282, doi:10.1002/anie.202524282.
J. Nehrkorn, S. Pfirrmann, Y. Lan, C. E. Anson, A. K. Powell, O. Waldmann
Synthesis and Magnetism of Co^III₂ Co^II₅ and Co^III₂ Co^II₆ Complexes, and the Role of the Free Choice of Local Coordinate Frames for Interpreting Magnetic Parameters
Eur. J. Inorg. Chem. 2026, e202500586, doi:10.1002/ejic.202500586.
R. Panda, F. Flecken, C. Papke, C. E. Anson, T. Grell, S. Hanf
Coordination Chemistry at the Hard−Soft Interface: Phosphine
Oxide-Based Rare Earth/Transition Metal Complexes
ACS Omega 2026, 11, 15462-15475, doi:10.1021/acsomega.5c13312.
M. A. Parker, D. Hauschild, R. Priya, C. Wansorra, R. Steininger, B. Peerless, L. Weinhardt, C. Heske, S. Dehnen
Bimetallic Bismuth-Based Nanoparticles From Pseudo-Tetrahedral Zintl Anions
Small 2026, e73221, in press, doi:10.1002/smll.73221.
V. Rai, C. Holzer, C. Rockstuhl, W. Wulfhekel, L. Gerhard
Gating Upconversion Electroluminescence in a Single Molecule via
Adsorption-Induced Interaction of Unpaired Spin
ACS Nano 2026, in press, doi:10.1021/acsnano.5c14042.
H. Ramanantoanina, B. Schacherl, A. Kovács, M. Tagliavini, E. M. Reynolds, C. Reitz, R. S. K. Ekanayake, M. Schäfer, P.-V. von Massow, J. Göttlicher, R. Steininger, K. Dardenne, M. W. Haverkort, M. Benešová-Schäfer, T. Vitova
High-energy resolution X-ray spectroscopy reveals bonding characteristics of La³⁺ homologues of actinium radiopharmaceuticals
Commun. Chem. 2026, 9, 148, doi:10.1038/s42004-026-01929-4.

2025

J. Arneth, X.-F. Li, J. Braun, S. Paul, Michael Schulze, C. E. Anson, W. Wernsdorfer, A. K. Powell, R. Klingeler
The Interplay of Single Ion Anisotropy and Magnetic 3d-4f Interactions in V^III₂Ln^III₂ Butterfly Complexes
ChemistryEurope 2025, 3, e202500011, doi:10.1002/ceur.202500011.
S. Aziza, S. Iimura, C. Jin, K. Fink, S. Hayun, T. Livneh
Order−Disorder Transitions in Cerium Hydrides, Manifested in Temperature-Dependent Raman Scattering Spectroscopy
J. Phys. Chem. C 2025, 129, 16826-16843, doi:10.1021/acs.jpcc.5c04145.
S. Baweja, M. M. Kappes, A. Schäfer, A. Znotins, R. Zielke, C. Holzer, T. Neumann, C. Kruck, M. Seitz
Direct Measurement of 4f−4f Transitions and Electronic Hot Bands in Lanthanoid-Antenna Complexes by Helium-Tagging Spectroscopy: Toward Molecular-Scale Trapped Ion Qubits
J. Chem. Phys. Lett. 2025, 16, 13046-13053, doi:10.1021/acs.jpclett.5c03294.
K. Beuthert, N. Spang, D. C. Alzate Millan, L. Guggolz, S. Dehnen
Expanding the Toolbox: Synthesis of Zintl Salts Containing Anionsof the In/Sb and Tl/Sb Elemental Combinations
Inorg. Chem. 2025, 64, 8711-8718, doi:10.1021/acs.inorgchem.5c00724.
W. J. A. Blackmore, Y. Chen, S. Klyatskaya, A. Mattioni, O. Fuhr, M. Ruben, N. F. Chilton
Re-Examination of the Relaxation Dynamics of [TbPc₂][NBu₄]
Inorg. Chem. 2025, 64, 17745-17753, doi:10.1021/acs.inorgchem.5c01913.
J. Braun, J. Leier, M. Khorenko, N. Leblanc, C. E. Anson, W. Klopper, C. Feldmann, C. Bizzarri, A.-N. Unterreiner, A. K. Powell
Stability and Ultrafast Dynamics of Luminescent Biquinoxen-Bis-σH-Adducts
Molecules 2025, 30, 4115, doi:10.3390/molecules30204115.
J. Braun, C. Pachl, O. Fuhr, G. E. Kostakis, J. Tang, C. E. Anson, K. Fink, A. K. Powell
An Unexpected Tetragonal Network of Seven-Connected Er₆ Clusters Stabilized by Multiple Halogen Bonds through Cooperative Effects
Cryst. Growth Des. 2025, 25, 6593-6603, doi:10.1021/acs.cgd.5c00517.
A. B. Carter, J. Braun, T. Bodenstein, R. F. Pfleger, M. Schulze, T. Kriese, S. F. M. Habermann, D. Liu, A. A. Al-Kathani, E. Moreno-Pineda, C. E. Anson, W. Wernsdorfer, L. F. Chibotaru, K. Fink, A. K. Powell
Using a Radical Straitjacket to Enforce an Ultrashort Dy-Dy Distance and thus Enhance Dipolar Interactions in a Dy^III₂ Dimer
Inorg. Chem. 2025, 64, 25036-25043, doi:10.1021/acs.inorgchem.5c04406.
P. Chakraborty, M. Link, C. Plett, M. Neumaier, P. Weis, M. Ibrahim, S. Grimme, M. M. Kappes
Polyoxometalate–cyclodextrin aggregates in isolation: probing the conformer space and binding affinities
Nanoscale 2025, 17, 22988-22999, doi:10.1039/d5nr02831k.
I. Ciubotaru, L. C. Biener, V. A. Vetsova, P. Weis, M. Seitz, L. J. Daumann
The Elusive Chemistry of Pyrroloquinoline Quinone Dimethyl Ester Lanthanide Complexes in Biomimetic Alcohol Oxidation
Eur. J. Inorg. Chem. 2025, 28, e202500102, doi:10.1002/ejic.202500102.
A. Ebert, L. Gerhard, J. Feye, S. K. Kuppusamy, B. Brachnakova, M. Ruben, P. W. Roesky, W. Wulfhekel
Photoluminescence and self-assembly of three different Eu complexes
Phys. Chem. Chem. Phys. 2025, 27, 13984-13990, doi:10.1039/D5CP01079A.
T. Eichhorn, N. Jobbitt, S. Bieling, S. Liu, T. Krom, D. Serrano, R. Huber, U. Lemmer, H. de Riedmatten, P. Goldner, D. Hunger
Multimodal Purcell enhancement and optical coherence of Eu³⁺ ions in a single nanoparticle coupled to a microcavity
Nanophotonics 2025, 14, 1817-1826, doi:10.1515/nanoph-2024-0721.
L.-P. Faden, C. Donsbach, R. Popescu, L. Bayarjargal, Y. M. Eggeler, B. Winkler, C. Feldmann
Structures and optical properties of cyclic-ether complexes of europium/ytterbium made via a redox approach
J. Mater. Chem. C 2025, 13, 23269-23279, doi:10.1039/D5TC02776D.
L.-P. Faden, L. Bayarjagal, V. Milman, B. Winkler, C. Feldmann
Crown-ether coordination compounds of zirconium, hafnium and scandium using metal nanoparticles
Dalton Trans. 2025, 54, 9670-9678, doi:10.1039/d5dt00968e.
D. Frick, E. Pross, R. Köppe, P. W. Roesky
Synthesis of Molecular Organo-f-Element-Polyphosphides with Nonclassical Divalent Lanthanide Precursors
Angew. Chem. Int. Ed. 2025, 64, e202503403, doi:10.1002/anie.202503403.
A. P. Fritz, L. J. Daumann, S. Schwarzer
Bioleaching of Rare Earth Fluorescent Lamp Phosphors Using Kombucha
J. Chem. Educ. 2025, 102, 2096-2102, doi:10.1021/acs.jchemed.4c01532.
S. M. Gutenthaler-Tietze, J. Kretzschmar, S. Tsushima, R. Steudtner, B. Drobot, L. J. Daumann
Reversing Lanmodulin's Metal-Binding Sequence in Short Peptides Surprisingly Increases the Lanthanide Afﬁnity
Angew. Chem. Int. Ed. 2025, 64, e202510453, doi:10.1002/anie.202510453.
S. M. Gutenthaler-Tietze, L. J. Daumann, P. Weis
Lanthanide-Binding Lanmodulin-Based Peptides: Insights from Advanced Mass Spectrometry Techniques
Eur. J. Inorg. Chem. 2025, 28, e202500258, doi:10.1002/ejic.202500258.
J.-G. Hartmann, D. Jankovic, R. Pasquier, M. Ruben, P.-A. Hervieux
Nonlinearity of the Fidelity in Open Qudit Systems: Gate and Noise Dependence in High-dimensional Quantum Computing
Quantum 2025, 9, 1690, doi:10.22331/q-2025-04-07-1690.
M. Iqbal, V. R. Naina, X. Sun, Shubham, P. W. Roesky
Alkali Metal Complexes of a Phosphine-Functionalized Cyclooctatetraene
Chem. Eur. J. 2025, 31, e02313, doi:10.1002/chem.202502313.
A. Jana, Y. Wang, L. Guggolz, Y. Chen, F. Ganslmaier, B. Weinert, M. Ruben, S. Dehnen
Bonding Features and Magnetic Ordering inThiolate-Bridged Copper-Nickel Clusters Synthesized at Elevated Temperature
Small 2025, 21, e06920, doi:10.1002/smll.202506920.
S. V. Klementyeva, M. T. Gamer, M. Schulze, N. Suryadevara, A. S. Bogomyakov, P. A. Abramov, S. N. Konchenko, M. Ruben, W. Wernsdorfer, E. Moreno-Pineda
Dinuclear Rare-Earth β‑Diketiminates with Bridging 3,5-Ditert-butyl-catecholates: Synthesis, Structure, and Single-Molecule Magnet Properties
Inorg. Chem. 2025, 64, 701-715, doi:10.1021/acs.inorgchem.4c03278.
J. Komeda, S. Schlittenhardt, A. Mizuno, E. Moreno-Pineda, Y. Chen, O. Fuhr, J. L. Appleton, A. K. Boudalis, S. Klyatskaya, M. Ruben
A Stable Radical in Cationic Dinuclear Rare-Earth Triple-Decker Complexes Featuring Switchable Magnetic Properties
J. Am. Chem. Soc. 2025, 147, 39367-39378, doi:10.1021/jacs.5c11362.
M. L. Kronenberger, D. Steinmetz, A. Appenzeller, A. Pausch
The Berry curvature in the framework of current density functional theory for molecules in external magnetic fields
J. Chem. Phys. 2025, 163, 224114, doi :10.1063/5.0300324.
C. Kruck, T. Neumann, A. Schäfer, E. Kreidt, P. Weis, C. Holzer, M. M. Kappes, M. Seitz
Lanthanoid Luminophores with Linear, Bipyridine-Based Antenna Ligands
Inorg. Chem. 2025, 64, 22048-22058, doi: 10.1021/acs.inorgchem.5c03839.
X. Liao, Y. Chen, T. Xie, R.-J. Sun, L.-Z. Yang, C.-F. Liu, R. Wang, S. Klyatskaya, M. Ruben, W. Zhang, Y.-S. Fu
Spatially dependent f-π exchange interaction within a single-molecule magnet TbPc₂
Nat. Commun. 2025, 16, 6263, doi:10.1038/s41467-025-61594-4.
X. Liao, R.-J. Sun, E. Minamitani, L.-Z. Yang, T. Xie, W.-H. Zhang, C. Liu, S. Klyatskaya, M. Ruben, Y.-S. Fu
Self-Stabilized Charge States in a Double-Decker Molecular Magnet on Pb(111)
J. Am. Chem. Soc. 2025, 147, 24422-24429, doi:10.1021/jacs.5c03347.
J. Mutschler, T. Ruppert, Y. Peng, S. Schlittenhardt, Y. F. Schneider, J. Braun, C. E. Anson, J. Ollivier, Q. Berrod, J.-M. Zanotti, M. Ruben, A. K. Powell, O. Waldmann
Finding lanthanide magnetic anisotropy axes in 3d-4f butterfly single-molecule magnets using inelastic neutron scattering
Cell Rep. Phys. Sci., 2025, 6, 102848, doi:10.1016/j.xcrp.2025.102848.
J. Mutschler, T. Ruppert, J. Strahringer, S. Schlittenhardt, A. Z. Ali, Y. Peng, C. E. Anson, M. Ruben, A. K. Powell, O. Waldmann
Transferability of Ligand Field Parameters in a Family of 3d-4f M₂Ln₂ Butterfly Single-Molecule Magnets
Inorg. Chem. 2025, 64, 6115-6124, doi:10.1021/acs.inorgchem.4c05421.
Y. Nakajima, P. Weis, F. Weigend, M. Lukanowski, F. Misaizu, M. M. Kappes
Lanthanide chloride clusters, Ln_xCl_3x+1^–, x = 1-6: an ion mobility and DFT study of isomeric structures and interconversion timescales
Phys. Chem. Chem. Phys. 2025, 27, 1017-1030, doi:10.1039/D4CP04057K.
S. Palkhivala, L. Kohler, C. Ritschel, C. Feldmann, D. Hunger
Accurate Single-Nanoparticle Sizing down to 3 nm with an Optofluidic Microcavity
ACS Nano 2025, 19, 39320-39326, doi:10.1021/acsnano.5c13782.
R. Panda, F. Rang, F. Flecken, P. Weis, S. Schneider, P. Théato, S. Hanf
Rare earth–transition metal cooperativity in the ring-opening polymerisation of tetrahydrofuran
Polym. Chem. 2025, 16, 4524-4528, doi:10.1039/d5py00853k.
S. Paul, M. Dolai, J. N. Goswami, B. Bhattacharya, F. Emmerling, M. G. B. Drew, S. Chattopadhyay, R. S. Sarkar, A. Sunil, G. Novitchi, E. Moreno-Pineda, W. Wernsdorfer
From strong to weak interaction: reconciling SQUID and µSQUID-EPR data in anomalous Co(II) dimers
Inorg. Chem. Front. 2025, 12, 6460-6472, doi:10.1039/D5QI01387A.
R. Pawlak, J.-C. Liu, C. Li, R. Hess, H. Chen, C. Drechsel, P. Zhou, X. Liu, R. Häner, U. Aschauer, T. Glatzel, S. Decurtins, D. Loss, J. Klinovaja, S.-X. Liu, W. Wulfhekel, E. Meyer
Toward Gate-Tunable Topological Superconductivity in a Supramolecular Electron Spin Lattice
Nano Lett. 2025, 25, 15206-15214, doi:10.1021/acs.nanolett.5c03396.
R. F. Pfleger, M. Briganti, N. Bonde, J. Ollivier, J. Braun, T. Bergfeldt, S. Piligkos, T. Ruppert, C. E. Anson, M. Perfetti, J. Bendix, A. K. Powell
Dinuclear Dysprosium Compounds: The Importance of Rigid Bridges
Chem. Eur. J. 2025, 31, e202403002, doi:10.1002/chem.202403002.
H. Ramanantoanina, J. Rienmüller, Y. R. Lohse, N. Rauwolf, M. Kehry, C. Reitz, E. M. Reynolds, T. Prüßmann, B. Schacherl, V. A. Saveleva, R. S. K. Ekanayake, J. Göttlicher, B. Weinert, W. Klopper, S. Dehnen, T. Vitova
Molecular-metallic binding characteristics of the intermetalloid f-/p-block cluster [(La@In₂Bi₁₁)2Bi2]⁶⁻
Angew. Chem. Int. Ed. 2025, 64, e202512019, doi: 10.1002/anie.202512019.
A. Reiß, A. Appenzeller, J. J. Baur, J. O. Wenzel, R. Popescu, K. Beuthert, S. Dehnen, Y. M. Eggeler, F. Breher, W. Klopper, C. Feldmann
Terbium and Vanadium Metal Nanoparticles Reactive Starting Materials for Liquid-Phase Syntheses
Small 2025, 21, 2503498, doi:10.1002/smll.202503498.
A. Reiß, J. J. Baur, R. Popescu, Y. M. Eggeler, C. Feldmann
Terbium Carbazolate: Synthesis with Terbium Nanoparticles, Structure, and Luminescence
Z. Anorg. Allg. Chem. 2025, 651, e202500088, doi:10.1002/zaac.202500088.
C. Ritschel, A. Appenzeller, R. Popescu, C. Donsbach, R. Köppe, J. O. Wenzel, F. Breher, Y. M. Eggeler, W. Klopper, C. Feldmann
Redox Reactions with Calcium-Metal Nanoparticles
Angew. Chem. Int. Ed. 2025, 64, e202515995, doi:10.1002/anie.202515995.
C. Ritschel, L. J. Daumann, C. Feldmann
Inorganic-organic hybrid nanoparticles with carbonate-triggered emission-colour-shift
Dalton Trans. 2025, 54, 1348-1353, doi:10.1039/d4dt02344g.
A. Schäfer, S. Debnath, R. Ayin, S. Baweja, D. Graf, S. Lebedkin, M. M. Kappes
Helium Tagging Spectroscopy of Isolated Cationic Dyes in Metastable Triplet States
J. Phys. Chem. Lett. 2025, 16, 6688-6695, doi:10.1021/acs.jpclett.5c01319.
A. Schmidt, J. Rienmüller, F. Weigend, S. Dehnen
Affecting Charges and Structures of {Bi₆} Architectures by 12-Electron Transition Metal Fragments
Angew. Chem. Int. Ed. 2025, 64, e202417234, doi:10.1002/anie.202417234.
N. Schwarz, F. Bruder, V. Bayer, E. Moreno-Pineda, S. Gillhuber, X. Sun, J. van Slageren, F. Weigend, P. W. Roesky
Rare earth stibolyl and bismolyl sandwich complexes
Nat. Commun. 2025, 16, 983, doi:10.1038/s41467-024-55474-6.
E. Stapf, A. Hinz
Divalent Lanthanide Hydride Complexes
Eur. J. Inorg. Chem. 2025, 28, e202400593, doi:10.1002/ejic.202400593.
D. Steinmetz, A. Pausch
Novel pseudomomentum-translational sum rule for the molecular Berry curvature
J. Chem. Phys. 2025, 162, 154109, doi:10.1063/5.0261461.
M. Steurer, X. Wu, A. C. Morrissey, K. Faershteyn, M. Fladung, P. Somers, F. Feist, M. Bastmeyer, M. Wegener, C. Feldmann, C. Barner-Kowollik
Color and fluorescence switchable 2D and 3D printed hybrid materials
Mater. Horiz. 2025, 12, 9139-9148, doi:10.1039/d5mh00564g.
X. Sun, G. Nocton, P. W. Roesky
Advances in lanthanide cyclononatetraenyl chemistry
Chem. Commun. 2025, 61, 1761-1772, doi:10.1039/D4CC05896H.
X. Sun, S. Schlittenhardt, T. Ruan, M. Saito, M. Ruben, P. W. Roesky
Magnetic properties of monomeric and polymeric stannolediide yttrium and erbium complexes
Commun. Chem. 2025, 8, 368, doi:10.1038/s42004-025-01797-4.
X. Sun,F. Krätschmer,J. Feye, M. Lukanowski, D. Graf, S. Lebedkin,M. Kappes,F. Weigend, P. W. Roesky,A. Hinz
Distinct Ligand- and Metal-Centered Phosphorescence in a Terbium Carbazolyl Complex
Chem. Eur. J. 2025, e202503208, doi:10.1002/chem.202503208.
D. Tesfaye, M. Gebrezgiabher, J. Braun, J. Kuchár, J. Černák, A. Abebe, P. Boulet, N. Kalarikkal, T. Hochdörffer, V. Schünemann, C. E. Anson, M. Thomas, A. K. Powell
Broad spin crossover in an iron(iii) Schiff base complex with a cis-FeN₄O₂ coordination environment
New J. Chem. 2025, 49, 14776-14781, doi:10.1039/D5NJ02493E.
C. Uhlmann, L. Münzfeld, A. Hauser, S. Gillhuber, P. Hädinger, M. Leskov, F. Weigend, P. W. Roesky
A Novel Synthetic Pathway to Lanthanide Triple-Decker Complexes: Selective Expansion of a Sandwich Complex by an Insertion Reaction
Angew. Chem. Int. Ed. 2025, e202503942, doi:10.1002/anie.202503942.
L. Winkler, A. Hinz
Stabilisation of a Strontium Hydride with a Monodentate Carbazolyl Ligand and its Reactivity
Angew. Chem. Int. Ed. 2025, 64, e202418558, doi:10.1002/anie.202418558.
R. Zielke, F. Weigend, C. Holzer
Excitations in lanthanide ions: a systematic evaluation of two-component CAS-CI and GW
Phys. Chem. Chem. Phys. 2025, 27, 12284-12293, doi:10.1039/D5CP00780A.

2024

M. Aryaeifar, H. A. Rudbari, E. Moreno-Pineda, J. V. Cuevas-Vicario, S. Paul, M. Schulze, W. Wernsdorfer, F. Lloret, N. Moini, O. Blacque
Synthesis, characterization and magnetic properties of halogenated tetranuclear cubane-like nickel(II) complexes
New J. Chem. 2024, 48, 3603-3613, doi:10.1039/d3nj05585j.
L. Batista, S. Paul, C. Molina-Jirón, J. A. Jaén, D. Fenske, O. Fuhr, M. Ruben, W. Wernsdorfer, E. Moreno-Pineda
Magnetic behaviour of a spin-canted asymmetric lanthanide quinolate trimer
Dalton Trans. 2024, 53, 12927-12935, doi:10.1039/d4dt01588f.
J. Braun, A. K. Powell, A.-N. Unterreiner
Gaining Insights into the Interplay between Optical and Magnetic Properties in Photoexcited Coordination Compounds
Chem. Eur. J. 2024, e202400977, doi:10.1002/chem.202400977.
J. Braun, D. Seufert, C. E. Anson, J. Tang, A. K. Powell
An Effectively Uncoupled Gd₈ Cluster Formed through Fixation of Atmospheric CO₂ Showing Excellent Magnetocaloric Properties
Int. J. Mol. Sci. 2024, 25, 264, doi:10.3390/ijms25010264.
F. Bruder, F. Weigend, Y. J. Franzke
Application of the Adiabatic Connection Random Phase Approximation to Electron−Nucleus Hyperfine Coupling Constants
J. Phys. Chem. A 2024, 128, 7298-7310, doi:10.1021/acs.jpca.4c03794.
R. N. Din, A. C. Venu, T. Rudszuck, A. Vallet, A. Favier, A. K. Powell, G. Guthausen, M. Ibrahim, S. Krämer
Longitudinal and Transverse ¹H Nuclear Magnetic Resonance Relaxivities of Lanthanide Ions in Aqueous Solution up to 1.4 GHz/33 T
Molecules 2024, 29, 4956, doi:10.3390/molecules29204956.
L.-P. Faden, A. Reiß, R. Popescu, C. Donsbach, J. Göttlicher, T. Vitova, D. Gerthsen, C. Feldmann
Sc, Zr, Hf, and Mn Metal Nanoparticles: Reactive Starting Materials for Synthesis Near Room Temperature
Inorg. Chem. 2024, 63, 1020-1034, doi:10.1021/acs.inorgchem.3c03074.
F. Flecken, S. Hanf
PPX/PXP-type ligands (X = O and S) and their transition metal complexes: synthesis, properties and applications
Dalton Trans. 2024, 53, 17123-17131, doi:10.1039/D4DT02497D.
Y. J. Franzke, F. Bruder, S. Gillhuber, C. Holzer, F. Weigend
Paramagnetic Nuclear Magnetic Resonance Shifts for Triplet Systems and Beyond with Modern Relativistic Density Functional Methods
J. Phys. Chem. A 2024, 128, 670-686, doi:10.1021/acs.jpca.3c07093.
A. Hauser, L. Münzfeld, C. Uhlmann, S. Lebedkin, S. Schlittenhardt, T.-T. Ruan, M. M. Kappes, M. Ruben, P. W. Roesky
It's not just the size that matters: crystal engineering of lanthanide-based coordination polymers
Chem. Sci. 2024, 15, 1338-1347, doi:10.1039/D3SC03746K.
A. Hauser, L. Münzfeld, S. Schlittenhardt, C. Uhlmann, L. Leyen, E. Moreno-Pineda, M. Ruben, P. W. Roesky
Cycloheptatrienyl-Bridged Triple-Decker Complexes
J. Am. Chem. Soc. 2024, 146, 13760-13769, doi:10.1021/jacs.3c12214.
F. Hennrich, S. Ito, P. Weis, M. Neumaier, S. Takano, T. Tsukuda, M. M. Kappes
Cyclic ion mobility of doped [MAu₂₄L₁₈]²⁻ superatoms and their fragments (M = Ni, Pd and Pt; L = alkynyl)
Phys. Chem. Chem. Phys. 2024, 26, 8408-8418, doi:10.1039/d3cp06192b.
A. Hinz, L. Winkler, X. Sun
CO Reduction by Calcium and Ytterbium Hydride Complexes with a Bulky Monodentate Carbazolyl Ligand
Chem. Commun. 2024, 60, 11291-11294, doi:10.1039/D4CC03714F.
D. Janković, J.-G. Hartmann, M. Ruben, P.-A. Hervieux
Noisy qudit vs multiple qubits: conditions on gate efficiency for enhancing fidelity
npj Quantum Information 2024, 10, 59, doi:10.1038/s41534-024-00829-6.
D. Jin, C. Uhlmann, E. K. Schneider, T. Seifert, D. Graf, S. Lebedkin, P. Weis, M. M. Kappes, P. W. Roesky
Tin-Chelated Trisphosphineoxide Scorpionate Rare-Earth Porphyrinate Complexes: Synthesis and Photophysical Properties
Inorg. Chem. 2024, 52, 24762-24770, doi:10.1021/acs.inorgchem.4c04065.
J. Komeda, A. K. Boudalis, N. Montenegro-Pohlhammer, C. Antheaume, A. Mizuno, P. Turek, M. Ruben
Selective Transition Enhancement in a g-Engineered Diradical
Chem. Eur. J. 2024, e202400420, doi:10.1002/chem.202400420.
S. K. Kuppusamy, D. Hunger, M. Ruben, P. Goldner, D. Serrano
Spin-bearing molecules as optically addressable platforms for quantum technologies
Nanophotonics 2024, 13, 4357-4379, doi:10.1515/nanoph-2024-0420.
X. Liao, E. Minamitani, T. Xie, L. Yang, W. Zhang, S. Klyatskaya, M. Ruben, Y.-S. Fu
Altering Spin Distribution of Tb₂Pc₃ via Molecular Chirality Manipulation
J. Am. Chem. Soc. 2024, 146, 5901-5907, doi:10.1021/jacs.3c11882.
Y. R. Lohse, B. Weinert, B. Peerless, S. Dehnen
Synthesis of the (Sn₄Bi₄)^2- Anion by Mild Oxidation of (Sn₂Bi₂)^2-
Z. Anorg. Allg. Chem. 2024, e202300229, doi:10.1002/zaac.202300229.
A. S. Manvell, R. Pfleger, N. A. Bonde, M. Briganti, C. A. Mattei, T. B. Nannestad, H. Weihe, A. K. Powell, J. Ollivier, J. Bendix, M. Perfetti
LnDOTA puppeteering: removing the water molecule and imposing tetragonal symmetry
Chem. Sci. 2024, 15, 113-123, doi:10.1039/d3sc03928e.
F. Pan, B. Weinert, S. Dehnen
Effect of La³⁺ on the Formation of Endohedral Zintl Clusters Featuring In/Bi Shells
Inorg. Chem. 2024, 63, 9670-9675, doi:10.1021/acs.inorgchem.4c00192.
A. Panja, S. Paul, E. Moreno-Pineda, R. Herchel, N. C. Jana, P. Brandão, G. Novitchi, W. Wernsdorfer
Insight into ferromagnetic interactions in Cu^II–Ln^III dimers with a compartmental ligand
Dalton Trans. 2024, 53, 2501-2511, doi:10.1039/d3dt03557c.
Y. Peng, J. Braun, M. Schulze, H. Kaemmerer, Y. F. Schneider, C. E. Anson, W. Wernsdorfer, A. K. Powell
A nested spin structure and single molecule magnet behaviour in an Fe₈Dy₁₂ heterometallic cyclic coordination cluster
Dalton Trans. 2024, 53, 894-897, doi:10.1039/d3dt04141g.
R. F. Pfleger, M. Briganti, N. Bonde, J. Ollivier, J. Braun, T. Bergfeldt, S. Piligkos, T. Ruppert, C. E. Anson, M. Perfetti, J. Bendix, A. K. Powell
Dinuclear Dysprosium Compounds: The Importance of Rigid Bridges
Chem. Eur. J. 2024, e202403002, doi:10.1002/chem.202403002.
N. Rauwolf, W. Klopper, C. Holzer
Non-linear light-matter interactions from the Bethe-Salpeter equation
J. Chem. Phys. 2024, 160, 061101, doi:10.1063/5.0191499.
T.-T. Ruan, E. Moreno-Pineda, S. Paul, M. Schulze, S. Schlittenhardt, A. Mizuno, W. Wernsdorfer, M. Ruben
Modulating quantum tunnelling of magnetization in Dy isotopologue dimers
Dalton Trans. 2024, 53, 17281-17290, doi:10.1039/D4DT01769B.
A. Schäfer, S. Debnath, J. Tränkle, T. Mohr, M. M. Kappes
Acriflavine Is More than It Seems: Resolving Optical Properties of Multiple Isomeric Constituents at 5 K
J. Phys. Chem. Lett. 2024, 15, 7295-7301, doi:10.1021/acs.jpclett.4c01517.
A. Schäfer, S. Giannini, D. Strelnikov, T. Mohr, F. Santoro, J. Cerezo, M. M. Kappes
Influence of symmetry breaking on the absorption spectrum of crystal violet: from isolated cations at 5 K to room temperature solutions
Phys. Chem. Chem. Phys. 2024, 26, 28514-28524, doi:10.1039/d4cp03825h.
S. Schlittenhardt, E. Vasilenko, V. Unni C., N. Jobbitt, O. Fuhr, D. Hunger, M. Ruben, S. K. Kuppusamy
Spectral Hole-Burning Studies of a Mononuclear Eu(III) Complex Reveal Narrow Optical Linewidths of the ⁵D₀ → ⁷F₀ Transition and Seconds Long Nuclear Spin Lifetimes
ChemPhysChem 2024, 25, e202400280, doi:10.1002/cphc.202400280.
N. Schwarz, F. Krätschmer, N. Suryadevara, S. Schlittenhardt, M. Ruben, P. W. Roesky
Synthesis, Structural Characterization, and Magnetic Properties of Lanthanide Arsolyl Sandwich Complexes
Inorg. Chem. 2024, 63, 9520-9526, doi:10.1021/acs.inorgchem.3c03374.
C. Uhlmann, L. Münzfeld, A. Hauser, T.-T. Ruan, S. K. Kuppusamy, C. Jin, M. Ruben, K. Fink, E. Moreno-Pineda, P. W. Roesky
Unique Double and Triple Decker Arrangements of Rare-Earth 9,10-Diborataanthracene Complexes Featuring Single-Molecule Magnet Characteristics
Angew. Chem. Int. Ed. 2024, 63, e202401372, doi:10.1002/anie.202401372.
T. Vitova, H. Ramanantoanina, B. Schacherl, L. Münzfeld, A. Hauser, R. S. K. Ekanayake, C. Y. Reitz, T. Prüßmann, T. S. Neill, J. Göttlicher, R. Steininger, V. A. Saveleva, M. W. Haverkort, P. W. Roesky
Photon-Modulated Bond Covalency of [Sm(II)(η⁹-C₉H₉)₂]
J. Am. Chem. Soc. 2024, 146, 20577-20583, doi:10.1021/jacs.3c13934.
L. Winkler, E. Stapf, A. Hinz
Hydride Abstraction from a BH₄^– Anion in a Carbazolyl Lanthanum Boranate
Organometallics 2024, 43, 2387-2391, doi:10.1021/acs.organomet.4c00095.
S. Wolf, R. Köppe, J. Treptow, W. Feuerstein, J. Wenzel, F. Breher, P. W. Roesky, F. Weigend, W. Klopper, C. Feldmann
[GeRu₆(CO)₁₈HI]: A Germanium-Centered Ruthenium Carbonyl Cluster with Aromatic Ring Current
Adv. Sci. 2024, 11, 2309043, doi:10.1002/advs.202309043.
Y. Yu, Y. Hao, B. Xiao, E. Langer, S. A. Novikov, H. Ramanantoanina, I. Pidchenko, D. Schild, T. E. Albrecht-Schoenzart, R.-A. Eichel, T. Vitova, E. V. Alekseev
U(V) Stabilization via Aliovalent Incorporation of Ln(III) into Oxo-salt Framework
Chem. Eur. J. 2024, 30, e202401033, doi:10.1002/chem.202401033.
A. M. Zytnick, S. M. Gutenthaler-Tietze, A. T. Aron, Z. L. Reitz, M. T. Phi, N. M. Good, D. Petras, L. J. Daumann, N. C. Martinez-Gomez
Identification and characterization of a small-molecule metallophore involved in lanthanide metabolism
PNAS 2024, 121, e2322096121, doi:10.1073/pnas.2322096121.

2023

K. Beuthert, B. Peerless, S. Dehnen
Insight into the formation of bismuth-tungsten carbonyl clusters
Commun. Chem. 2023, 6, 109, doi:10.1038/s42004-023-00905-6.
F. Bruder, Y. J. Franzke, C. Holzer, F. Weigend
Zero-Field Splitting Parameters within Exact Two-Component Theory and Modern Density Functional Theory Using Seminumerical Integration
J. Chem. Phys. 2023, 159, 194117, doi:10.1063/5.0175758.
S. Debnath, A. Schäfer, S. Ito, D. Strelnikov, R. Schneider, K. A. Haupa, M. M. Kappes
Vibrationally Resolved Absorption, Fluorescence, and Preresonance Raman Spectroscopy of Isolated Pyronin Y Cation at 5 K
J. Phys. Chem. Lett. 2023, 14, 10553-10560, doi:10.1021/acs.jpclett.3c02651.
Y. J. Franzke, C. Holzer, J. H. Andersen, T. Begušić, F. Bruder, S. Coriani, F. Della Sala, E. Fabiano, D. A. Fedotov, S. Fürst, S. Gillhuber, R. Grotjahn, M. Kaupp, M. Kehry, M. Krstić, F. Mack, S. Majumdar, B. D. Nguyen, S. M. Parker, F. Pauly, A. Pausch, E. Perlt, G. S. Phun, A. Rajabi, D. Rappoport, B. Samal, T. Schrader, M. Sharma, E. Tapavicza, R. S. Treß, V. Voora, A. Wodyński, J. M. Yu, B. Zerulla, F. Furche, C. Hättig, M. Sierka, D. P. Tew, F. Weigend
TURBOMOLE: Today and Tomorrow
J. Chem. Theory Comput. 2023, 19, 6859-6890, doi:10.1021/acs.jctc.3c00347.
A. Jain, H. Karmakar, P. W. Roesky, T. K. Panda
Role of Bis(phosphinimino)methanides as Universal Ligands in the Coordination Sphere of Metals across the Periodic Table
Chem. Rev. 2023, 123, 13323-13373, doi:10.1021/acs.chemrev.3c00336.
S. K. Kuppusamy, E. Vasilenko, W. Li, J. Hessenauer, C. Ioannou, O. Fuhr, D. Hunger, M. Ruben
Observation of Narrow Optical Homogeneous Linewidth and Long Nuclear Spin Lifetimes in a Prototypical [Eu(trensal)] Complex
J. Phys. Chem. C 2023, 127, 10670-10679, doi:10.1021/acs.jpcc.3c02903.
L. Münzfeld, A. Hauser, M. T. Gamer, P. W. Roesky
Mono-cyclononatetraenyl lanthanide complexes
Chem. Commun. 2023, 59, 9070-9073, doi:10.1039/d3cc02717a.
L. Münzfeld, S. Gillhuber, A. Hauser, S. Lebedkin, P. Hädinger, N. D. Knöfel, C. Zovko, M. T. Gamer, F. Weigend, M. M. Kappes, P. W. Roesky
Synthesis and properties of cyclic sandwich compounds
Nature 2023, 620, 92-96, doi:10.1038/s41586-023-06192-4.
L. Münzfeld, M. Dahlen, A. Hauser, N. Mahieu, S. K. Kuppusamy, J. Moutet, M. Tricoire, R. Köppe, L. La Droitte, O. Cador, B. Le Guennic, G. Nocton, E. Moreno-Pineda, M. Ruben,P. W. Roesky
Molecular Lanthanide Switches for Magnetism and Photoluminescence
Angew. Chem. Int. Ed. 2023, 62, e202218107, doi:10.1002/anie.202218107.
V. Rai, N. Balzer, G. Derenbach, C. Holzer, M. Mayor, W. Wulfhekel, L. Gerhard, M. Valášek
Hot Luminescence from Single-Molecule Chromophores Electrically and Mechanically Self-Decoupled by Tripodal Scaffolds
Nat. Commun. 2023, 14, 8253, doi:10.1038/s41467-023-43948-y.
A. Reiß, M. K. Reimann, R. Popescu, D. Gerthsen, R. Pöttgen, C. Feldmann
Chromium Metal Nanoparticles, Their Reactivity and Reactions
Z. Anorg. Allg. Chem. 2023, 649, e202300137, doi:10.1002/zaac.202300137.
A. Reiß, M. K. Reimann, C. Jin, M. Wachter-Lehn, R. K. Kremer, R. Pöttgen, K. Fink, W. Klopper, C. Feldmann
Experimental and computational study of the exchange interaction between the V(III) centers in the vanadium-cyclal dimer
Dalton Trans. 2023, 52, 17389-17397, doi:10.1039/D3DT03243D.
T.-T. Ruan, E. Moreno-Pineda, M. Schulze, S. Schlittenhardt, T. Brietzke, H.-J. Holdt, S. K. Kuppusamy, W. Wernsdorfer, M. Ruben
Hilbert Space in Isotopologue Dy(III) SMM Dimers: Dipole Interaction Limit in [^163/164Dy₂(tmhd)₆(tape)]⁰ Complexes
Inorg. Chem. 2023, 62, 15148-15156, doi:10.1021/acs.inorgchem.3c02246.
M. Rutschmann, C. Feldmann
Perylene dye@SiO₂ core-shell nanoparticles with intense fluorescence
J. Mater. Chem. C 2023, 11, 616-621, doi:10.1039/d2tc03981h.
S. Schäfer, S. Kaufmann, E. S. Rösch, P. W. Roesky
Divalent metallocenes of the lanthanides – a guideline to properties and reactivity
Chem. Soc. Rev. 2023, 52, 4006-4045, doi:10.1039/d2cs00744d.
G. Taran, E. Bonet, E. Moreno-Pineda, M. Ruben, W. Wernsdorfer
Thermalization of Nuclear Spins in Lanthanide Molecular Magnets
Inorg. Chem. 2023, 62, 8598-8604, doi:10.1021/acs.inorgchem.3c00530.
G. Taran, E. Moreno-Pineda, M. Schulze, E. Bonet, M. Ruben, W. Wernsdorfer
Direct determination of high-order transverse ligand field parameters via µSQUID-EPR in a Et₄N[¹⁶⁰GdPc₂] SMM
Nat. Commun. 2023, 14, 3361, doi:10.1038/s41467-023-39003-5.

Disclaimer: Although we aim to update this list regularly to the best of our knowledge, it does not claim to be complete. Should any further questions arise, please contact us: webmaster∂sfb1573.kit.edu.