| A DyIII2 Dimer in a Radical Straitjacket: The Importance of Dipolar Interactions in Dysprosium Single Molecule Magnets AB Carter, J Braun, T Bodenstein, RF Pfleger, M Schulze, T Kriese, ... | | 2024 |
| Vibronic order and magnetism in cubic 5d 1 double perovskite compounds N Iwahara, Z Huang, LF Chibotaru Journal of Physics: Conference Series 2769 (1), 012011, 2024 | | 2024 |
| New tool for extraction of Os M\"ossbauer parameters with biologically relevant detection sensitivity I Stepanenko, Z Huang, L Ungur, D Bessas, A Chumakov, I Sergueev, ... arXiv preprint arXiv:2404.18683, 2024 | | 2024 |
| Building Molecular Nanomagnets by Encapsulating Lanthanide Ions in Boron Nitride Nanotubes: Ab Initio Investigation D Liu, X Guo, X Zhang, AA Al-Kahtani, LF Chibotaru Inorganic Chemistry 63 (8), 3769-3780, 2024 | | 2024 |
| First-principles derivation of elastic interaction between Jahn-Teller centers in crystals via lattice Green's functions Z Huang, N Iwahara, LF Chibotaru arXiv preprint arXiv:2401.08204, 2024 | | 2024 |
| Increasing the Magnetic Blocking Temperature of Single‐Molecule Magnets V Vieru, S Gómez‐Coca, E Ruiz, LF Chibotaru Angewandte Chemie 136 (2), e202303146, 2024 | 10 | 2024 |
| Ab Initio Investigation of Anisotropic Magnetism and Magnetization Blocking in Metal Complexes LF Chibotaru Computational Modelling of Molecular Nanomagnets, 1-62, 2023 | 1 | 2023 |
| Vibronic order and emergent magnetism in cubic double perovskites N Iwahara, LF Chibotaru Physical Review B 107 (22), L220404, 2023 | 9 | 2023 |
| The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry G Li Manni, I Fdez. Galván, A Alavi, F Aleotti, F Aquilante, J Autschbach, ... Journal of chemical theory and computation 19 (20), 6933-6991, 2023 | 87 | 2023 |
| Single-ion magnet behavior of Ln 3+ encapsulated in carbon nanotubes: an ab initio insight D Liu, X Guo, X Zhang, AA Al-Kahtani, LF Chibotaru Dalton Transactions 52 (32), 11243-11253, 2023 | 1 | 2023 |
| Dynamic Jahn-Teller effect and emergent magnetism in cubic 5d1 double perovskites N Iwahara, L Chibotaru APS March Meeting Abstracts 2023, K39. 002, 2023 | | 2023 |
| Non-monotonic temperature dependence and first-order phase transition of relaxation times in molecular spin LTA Ho, L Ungur, LF Chibotaru arXiv preprint arXiv:2212.13078, 2022 | | 2022 |
| Coherence/incoherence transition temperature in molecular spin LTA Ho, L Ungur, LF Chibotaru arXiv preprint arXiv:2212.13092, 2022 | | 2022 |
| Dissipative Landau-Zener transition with decoherence rate LTA Ho, L Ungur, LF Chibotaru arXiv preprint arXiv:2212.13093, 2022 | | 2022 |
| Quantum tunneling of magnetization in molecular spin LTA Ho, L Ungur, LF Chibotaru arXiv preprint arXiv:2212.13086, 2022 | | 2022 |
| A High-Performance Single-Molecule Magnet Utilizing Dianionic Aminoborolide Ligands JC Vanjak, BO Wilkins, V Vieru, NS Bhuvanesh, JH Reibenspies, ... Journal of the American Chemical Society 144 (39), 17743-17747, 2022 | 64 | 2022 |
| Mechanisms of luminescence in lanthanide complexes: a crucial role of metal–ligand covalency L Ungur, B Szabo, ZA ALOthman, AAS Al-Kahtani, LF Chibotaru Inorganic Chemistry 61 (16), 5972-5976, 2022 | 13 | 2022 |
| Multipolar exchange interaction and complex order in insulating lanthanides N Iwahara, Z Huang, I Neefjes, LF Chibotaru Physical Review B 105 (14), 144401, 2022 | 6 | 2022 |
| Toroidal versus centripetal arrangement of the magnetic moment in a Dy4 tetrahedron Q Yang, L Ungur, LF Chibotaru, J Tang Chemical Communications 58 (11), 1784-1787, 2022 | 18 | 2022 |
| Synchronous Temperature and Magnetic Field Dual‐Sensing by Luminescence in a Dysprosium Single‐Molecule Magnet RAS Ferreira, E Mamontova, AMP Botas, M Shestakov, J Vanacken, ... Advanced Optical Materials 9 (24), 2101495, 2021 | 29 | 2021 |
Liviu UngurDepartment of Chemistry, National University of Singapore在 nus.edu.sg 的电子邮件经过验证
