List of QCEXVAL publications in 2020:
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“On the chemiluminescence emission of luminol: protic and aprotic solvents and encapsulation to improve the properties in aqueous solution” Ana Borrego-Sánchez, Angelo Giussani, Mercedes Rubio and Daniel Roca-Sanjuán Physical Chemistry Chemical Physics (2020), Vol. 22, 27617 – 27625 |
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“A Series of Ultra-Efficient Blue Borane Fluorophores” Jonathan Bould, Kamil Lang, Kaplan Kirakci, Luis Cerdán, Daniel Roca-Sanjuán, Antonio Francés-Monerris, William Clegg, Paul G. Waddell, Marcel Fuciman, Tomáš Polívka and Michael G. S. Londesborough Inorganic Chemistry (2020), Vol. 59, 17058 – 17070 |
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“Photochemistry of oxidized Hg(I) and Hg(II) species suggests missing mercury oxidation in the troposphere” Alfonso Saiz-Lopez, Oleg Travnikov, Jeroen E. Sonke, Colin P. Thackray, Daniel J. Jacob, Javier Carmona-García, Antonio Francés-Monerris, Daniel Roca-Sanjuán, A. Ulises Acuña, Juan Z. Dávalos, Carlos A. Cuevas, Martin Jiskra, Feiyue Wang, Johannes Bieser, John M. C. Plane and Joseph S. Francisco Proceedings of the National Academy of Sciences (2020), Vol. 117, 30949 – 30956 |
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“Regiochemical memory in the adiabatic photolysis of thymine-derived oxetanes. A combined ultrafast spectroscopic and CASSCF/CASPT2 computational study” Alejandro Blasco-Brusola, Miriam Navarrete-Miguel, Angelo Giussani, Daniel Roca-Sanjuán, Ignacio Vayá and Miguel A. Miranda Physical Chemistry Chemical Physics (2020), Vol. 22, 20037 – 20042 |
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“Characterization of the locally excited and charge‐transfer states of the anticancer drug lapatinib by ultrafast spectroscopy and computational studies” Ignacio Vayá, Inmaculada Andreu, Emilio Lence, Concepción González-Bello, M. Consuelo Cuquerella, Miriam Navarrete-Miguel, Daniel Roca-Sanjuán and Miguel A. Miranda Chemistry – A European Journal (2020), Vol. 26, 15922 – 15930 |
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“Unveiling the role of upper excited electronic states in the photochemistry and laser performance of anti-B18H22“ Luis Cerdán, Antonio Francés-Monerris, Daniel Roca-Sanjuán, Jonathan Bould, Jiří Dolanský, Marcel Fuciman and Michael G. S. Londesborough Journal of Materials Chemistry C (2020), Vol. 8, 12806 – 12818 |
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“Photodissociation Mechanisms of Major Mercury (II) Species in the Atmospheric Chemical Cycle of Mercury” Antonio Francés-Monerris, Javier Carmona-García, A. Ulises Acuña, Juan Z. Dávalos, Carlos A. Cuevas, Douglas E. Kinnison, Joseph S. Francisco, Alfonso Saiz-Lopez and Daniel Roca-Sanjuán Angewandte Chemie International Edition (2020), Vol. 59, 7605 – 7610 |
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