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doc icon DUGiDocs 25 setembre 2025 Molecular aromaticity: a quantum phenomenon Solà i Puig, Miquel ; Szczepanik, Dariusz W.
out url icon Recercat Polarizable QM/MM multiconfiguration self-consistent field approach with state-specific corrections: Environment effects on cytosine absorption spectrum Li, Quansong ; Mennucci, Benedetta ; Robb, Michael A. ; Blancafort San José, Lluís ; Curutchet, Carles
doc icon DUGiDocs 2015 Polarizable QM/MM multiconfiguration self-consistent field approach with state-specific corrections: Environment effects on cytosine absorption spectrum Li, Quansong ; Mennucci, Benedetta ; Robb, Michael A. ; Blancafort San José, Lluís ; Curutchet, Carles
doc icon DUGiDocs 2011 Quantum dynamics study of fulvene double bond photoisomerization: The role of intramolecular vibrational energy redistribution and excitation energy Blancafort San José, Lluís ; Gatti, Fabien ; Meyer, Hans-Dieter
out url icon Recercat Quantum dynamics study of fulvene double bond photoisomerization: The role of intramolecular vibrational energy redistribution and excitation energy Blancafort San José, Lluís ; Gatti, Fabien ; Meyer, Hans-Dieter
out url icon Recercat Quantum dynamics study of fulvene double bond photoisomerization: The role of intramolecular vibrational energy redistribution and excitation energy Blancafort San José, Lluís ; Gatti, Fabien ; Meyer, Hans-Dieter
out url icon Recercat Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases Improta, Roberto ; Santoro, Fabrizio ; Blancafort San José, Lluís
doc icon DUGiDocs 23 març 2016 Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases Improta, Roberto ; Santoro, Fabrizio ; Blancafort San José, Lluís
doc icon DUGiDocs 1997 A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel
out url icon Recercat A quantum molecular similarity analysis of changes in molecular electron density caused by basis set flotation and electric field application Simon i Rabasseda, Sílvia ; Duran i Portas, Miquel
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