Mariano L.A., Mondal S., Lunghi A., Spin-Vibronic Dynamics in Open-Shell Systems beyond the Spin Hamiltonian Formalism, Journal of Chemical Theory and Computation, 20, (1), 2024, p323 - 332, p323-332 ,
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Fitzpatrick A., Nykanen A., Talarico N.W., Lunghi A., Maniscalco S., Garcia-Perez G., Knecht S., Self-Consistent Field Approach for the Variational Quantum Eigensolver: Orbital Optimization Goes Adaptive, Journal of Physical Chemistry A, 128, (14), 2024, p2843 - 2856, p2843-2856 ,
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Aaron Fitzpatrick, Anton Nykänen, N. Walter Talarico, Alessandro Lunghi, Sabrina Maniscalco, Guillermo García-Pérez, Stefan Knecht, Self-Consistent Field Approach for the Variational Quantum Eigensolver: Orbital Optimization Goes Adaptive, The Journal of Physical Chemistry A, 128, (14), 2024, p2843-2856 ,
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Lorenzo A. Mariano, Sourav Mondal, Alessandro Lunghi, Spin-Vibronic Dynamics in Open-Shell Systems beyond the Spin Hamiltonian Formalism, Journal of Chemical Theory and Computation, 20, (1), 2024, p323-332 ,
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Mariano, Lorenzo A., Nguyen, Vu Ha Anh, Briganti, Valerio, Lunghi, Alessandro, Charting Regions of Cobalt"s Chemical Space with Maximally Large Magnetic Anisotropy: A Computational High-Throughput Study, Journal of the American Chemical Society, 146, (49), 2024, p34158-34166 ,
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Spin-Phonon Relaxation in Magnetic Molecules: Theory, Predictions and Insights in, Springer International Publishing, 2023, pp219-289 , [Lunghi, Alessandro],
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Garlatti, E., Albino, A., Chicco, S., Nguyen, V. H. A., Santanni, F., Paolasini, L., Mazzoli, C., Caciuffo, R., Totti, F., Santini, P., Sessoli, R., Lunghi, A., Carretta, S., The critical role of ultra-low-energy vibrations in the relaxation dynamics of molecular qubits, Nature Communications, 14, (1), 2023,
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Dong, R., Lunghi, A., Sanvito, S., Stiffness and atomic-scale friction in superlubricant MoS2 bilayers, The Journal of Physical Chemistry Letters, 14, (26), 2023, 6086"6091 ,
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TARA - Full Text
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Mondal, Sourav, Lunghi, Alessandro, Spin-phonon decoherence in solid-state paramagnetic defects from first principles, npj Computational Materials, 9, (1), 2023,
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Briganti, Valerio, Lunghi, Alessandro, Efficient generation of stable linear machine-learning force fields with uncertainty-aware active learning, Machine Learning: Science and Technology, 4, (3), 2023, p035005 ,
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