Publisher Correction: Exciton transport in molecular organic semiconductors boosted by transient quantum delocalization
Giannini, Samuele, Peng, Wei-Tao, Cupellini, Lorenzo, Padula, Daniele, Carof, Antoine, Blumberger, Jochen
Published in Nature Communications (11.04.2024)
Published in Nature Communications (11.04.2024)
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Structural and Vibrational Properties of Carboxylates Intercalated into Layered Double Hydroxides: A Joint Computational and Experimental Study
Porwal, Vishal K, André, Erwan, Carof, Antoine, Bastida Pascual, Adolfo, Carteret, Cédric, Ingrosso, Francesca
Published in Molecules (Basel, Switzerland) (01.04.2024)
Published in Molecules (Basel, Switzerland) (01.04.2024)
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Molecular Hydrodynamics from Memory Kernels
Lesnicki, Dominika, Vuilleumier, Rodolphe, Carof, Antoine, Rotenberg, Benjamin
Published in Physical review letters (08.04.2016)
Published in Physical review letters (08.04.2016)
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Confronting surface hopping molecular dynamics with Marcus theory for a molecular donor-acceptor system
Spencer, Jacob, Scalfi, Laura, Carof, Antoine, Blumberger, Jochen
Published in Faraday discussions (01.01.2016)
Published in Faraday discussions (01.01.2016)
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Tautomeric contributions to the absorption spectrum of [2,2′-bipyridyl]-3,3′-diol in water unveiled by molecular dynamics with accurate quantum mechanically derived force-fields
Prampolini, Giacomo, Porwal, Vishal K., Carof, Antoine, Ingrosso, Francesca
Published in Journal of molecular liquids (15.02.2024)
Published in Journal of molecular liquids (15.02.2024)
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Study of Speciation and Transport Properties for Different Compositions of Carbonates in Li2CO3 –Na2CO3 and Li2CO3 –K2CO3 Binary Systems at High Temperature in Molten State
Zhadan, Antonii, Carof, Antoine, Sarou-Kanian, Vincent, del Campo, Leire, Cosson, Lionel, Vuilleumier, Rodolphe, Malki, Mohammed, Bessada, Catherine
Published in Journal of physical chemistry. C (15.06.2023)
Published in Journal of physical chemistry. C (15.06.2023)
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Study of Speciation and Transport Properties for Different Compositions of Carbonates in Li 2 CO 3 – Na 2 CO 3 and Li 2 CO 3 – K 2 CO 3 Binary Systems at High Temperature in Molten State
Zhadan, Antonii, Carof, Antoine, Sarou-Kanian, Vincent, del Campo, Leire, Cosson, Lionel, Vuilleumier, Rodolphe, Malki, Mohammed, Bessada, Catherine
Published in Journal of physical chemistry. C (15.06.2023)
Published in Journal of physical chemistry. C (15.06.2023)
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Carbon species solvated in molten carbonate electrolyser cell from first-principles simulations
Carof, Antoine, Coudert, François-Xavier, Corradini, Dario, Lesnicki, Dominika, Desmaele, Elsa, Vuilleumier, Rodolphe
Published in International journal of hydrogen energy (21.04.2021)
Published in International journal of hydrogen energy (21.04.2021)
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Cysteine Linkages Accelerate Electron Flow through Tetra-Heme Protein STC
Jiang, Xiuyun, Futera, Zdenek, Ali, Md. Ehesan, Gajdos, Fruzsina, von Rudorff, Guido F, Carof, Antoine, Breuer, Marian, Blumberger, Jochen
Published in Journal of the American Chemical Society (06.12.2017)
Published in Journal of the American Chemical Society (06.12.2017)
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