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Adalgisa Sinicropi
Adalgisa Sinicropi
University of Siena, R^2ES Lab, LifeCARES, CSGI, CNR-ICCOM
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Computational Photochemistry
M Olivucci, A Sinicropi
Computational Photochemistry in Theoretical and Computational Chemistry 16, 1-33, 2005
2012005
Properties of the emitting state of the green fluorescent protein resolved at the CASPT2//CASSCF/CHARMM level
A Sinicropi, T Andruniow, N Ferré, R Basosi, M Olivucci
Journal of the American Chemical Society 127 (33), 11534-11535, 2005
1752005
An artificial molecular switch that mimics the visual pigment and completes its photocycle in picoseconds
A Sinicropi, E Martin, M Ryazantsev, J Helbing, J Briand, D Sharma, ...
Proceedings of the National Academy of Sciences 105 (46), 17642-17647, 2008
1182008
Bathochromic shift in green fluorescent protein: a puzzle for QM/MM approaches
C Filippi, F Buda, L Guidoni, A Sinicropi
Journal of chemical theory and computation 8 (1), 112-124, 2012
1112012
Catalytic surface radical in dye-decolorizing peroxidase: a computational, spectroscopic and site-directed mutagenesis study
D Linde, R Pogni, M Canellas, F Lucas, V Guallar, MC Baratto, A Sinicropi, ...
Biochemical Journal 466 (2), 253-262, 2015
952015
Quantum chemical modeling and preparation of a biomimetic photochemical switch
F Lumento, V Zanirato, S Fusi, E Busi, L Latterini, F Elisei, A Sinicropi, ...
Angewandte Chemie 119, 418-424, 2007
912007
Excited state geometries and vertical emission energies of solvated dyes for DSSC: a PCM/TD-DFT benchmark study
C Bernini, L Zani, M Calamante, G Reginato, A Mordini, M Taddei, ...
Journal of Chemical theory and Computation 10 (9), 3925-3933, 2014
882014
Integration of two-dimensional materials-based perovskite solar panels into a stand-alone solar farm
S Pescetelli, A Agresti, G Viskadouros, S Razza, K Rogdakis, ...
Nature Energy 7 (7), 597-607, 2022
822022
Organic dyes with intense light absorption especially suitable for application in thin-layer dye-sensitized solar cells
A Dessì, M Calamante, A Mordini, M Peruzzini, A Sinicropi, R Basosi, ...
Chemical Communications 50 (90), 13952-13955, 2014
762014
Prospective life cycle assessment of third-generation photovoltaics at the pre-industrial scale: A long-term scenario approach
ML Parisi, S Maranghi, L Vesce, A Sinicropi, A Di Carlo, R Basosi
Renewable and Sustainable Energy Reviews 121, 109703, 2020
742020
Chromophore–protein coupling beyond nonpolarizable models: Understanding absorption in green fluorescent protein
C Daday, C Curutchet, A Sinicropi, B Mennucci, C Filippi
Journal of chemical theory and computation 11 (10), 4825-4839, 2015
742015
Structure of the intersection space associated with Z/E photoisomerization of retinal in rhodopsin proteins
A Migani, A Sinicropi, N Ferré, A Cembran, M Garavelli, M Olivucci
Faraday discussions 127, 179-191, 2004
702004
Modeling, Preparation, and Characterization of a Dipole Moment Switch Driven by Z/E Photoisomerization
A Melloni, R Rossi Paccani, D Donati, V Zanirato, A Sinicropi, ML Parisi, ...
Journal of the American Chemical Society 132 (27), 9310-9319, 2010
642010
Thiazolo [5, 4-d] thiazole-based organic sensitizers with strong visible light absorption for transparent, efficient and stable dye-sensitized solar cells
A Dessì, M Calamante, A Mordini, M Peruzzini, A Sinicropi, R Basosi, ...
RSC Advances 5 (41), 32657-32668, 2015
512015
Environmental profile of the manufacturing process of perovskite photovoltaics: harmonization of life cycle assessment studies
S Maranghi, ML Parisi, R Basosi, A Sinicropi
Energies 12 (19), 3746, 2019
482019
Characterization of radical intermediates in laccase-mediator systems. A multifrequency EPR, ENDOR and DFT/PCM investigation
B Brogioni, D Biglino, A Sinicropi, EJ Reijerse, P Giardina, G Sannia, ...
Physical Chemistry Chemical Physics 10 (48), 7284-7292, 2008
482008
Computational Photochemistry
J Michl, M Olivucci, A Sinicropi, M Merchán, L Serrano-Andrés, F Furche, ...
Elsevier, Amsterdam, 2005
482005
Thiazolo [5, 4-d] thiazole-based organic sensitizers with improved spectral properties for application in greenhouse-integrated dye-sensitized solar cells
A Dessì, M Calamante, A Sinicropi, ML Parisi, L Vesce, P Mariani, ...
Sustainable Energy & Fuels 4 (5), 2309-2321, 2020
472020
Computational methods in photochemistry
AG Kutateladze
CRC Press, 2005
472005
Mechanism of the Norrish-Yang Photocyclization Reaction of an Alanine Derivative in the Singlet State: Origin of the Chiral Memory Effect
A Sinicropi, F Barbosa, R Basosi, B Giese, M Olivucci
ANGEWANDTE CHEMIE. INTERNATIONAL EDITION 44 (16), 2390-2393, 2005
462005
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Artikler 1–20