Nguyen, Vu Ha Anh, Lunghi, Alessandro, Predicting tensorial molecular properties with equivariant machine learning models, Physical Review B, 105, (16), 2022,
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Lunghi A., Toward exact predictions of spin-phonon relaxation times: An ab initio implementation of open quantum systems theory, Science Advances, 8, (31), 2022,
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Mondal S., Lunghi A., Unraveling the Contributions to Spin-Lattice Relaxation in Kramers Single-Molecule Magnets, Journal of the American Chemical Society, 144, (50), 2022, p22965 - 22975, p22965-22975 ,
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Lunghi, A. and Sanvito, S., Computational design of magnetic molecules and their environment using quantum chemistry, machine learning and multiscale simulations, Nature Reviews Chemistry, 2022,
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Fabio Santanni, Andrea Albino, Matteo Atzori, Davide Ranieri, Enrico Salvadori, Mario Chiesa, Alessandro Lunghi, Andrea Bencini, Lorenzo Sorace, Federico Totti, Roberta Sessoli, Probing Vibrational Symmetry Effects and Nuclear Spin Economy Principles in Molecular Spin Qubits, Inorganic Chemistry, 2021,
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Lorenzo Poggini, Alessandro Lunghi, Alberto Collauto, Antonio Barbon, Lidia Armelao, Agnese Magnani, Andrea Caneschi, Federico Totti, Lorenzo Sorace, Matteo Mannini, Chemisorption of nitronyl"nitroxide radicals on gold surface: an assessment of morphology, exchange interaction and decoherence time, Nanoscale, 2021,
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Briganti, Matteo, Santanni, Fabio, Tesi, Lorenzo, Totti, Federico, Sessoli, Roberta, Lunghi, Alessandro, A Complete Ab Initio View of Orbach and Raman Spin"Lattice Relaxation in a Dysprosium Coordination Compound, Journal of the American Chemical Society, 2021,
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Poggini, Lorenzo, Tancini, Erik, Danieli, Chiara, Sorrentino, Andrea Luigi, Serrano, Giulia, Lunghi, Alessandro, Malavolti, Luigi, Cucinotta, Giuseppe, Barra, Anne"Laure, Juhin, Amélie, Arrio, Marie"Anne, Li, Weibin, Otero, Edwige, Ohresser, Philippe, Joly, Loïc, Kappler, Jean Paul, Totti, Federico, Sainctavit, Philippe, Caneschi, Andrea, Sessoli, Roberta, Cornia, Andrea, Mannini, Matteo, Engineering Chemisorption of Fe 4 Single"Molecule Magnets on Gold, Advanced Materials Interfaces, 8, (24), 2021, p2101182 ,
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Albino, Andrea, Benci, Stefano, Atzori, Matteo, Chelazzi, Laura, Ciattini, Samuele, Taschin, Andrea, Bartolini, Paolo, Lunghi, Alessandro, Righini, Roberto, Torre, Renato, Totti, Federico, Sessoli, Roberta, Temperature Dependence of Spin"Phonon Coupling in [VO(acac)2]: A Computational and Spectroscopic Study, The Journal of Physical Chemistry C, 125, (40), 2021, p22100-22110 ,
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Yanhui Zhang, Alessandro Lunghi, Stefano Sanvito, Pushing the limits of atomistic simulations towards ultra-high temperature: A machine-learning force field for ZrB2, Acta Materialia, 186, 2020, p467--474 ,
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