Marika Savarese
Marika Savarese
Department of Drug Discovery and Development, Istituto Italiano di Tecnologia IIT
Verified email at iit.it
Title
Cited by
Cited by
Year
Fluorescence lifetimes and quantum yields of rhodamine derivatives: new insights from theory and experiment
M Savarese, A Aliberti, I De Santo, E Battista, F Causa, PA Netti, N Rega
The Journal of Physical Chemistry A 116 (28), 7491-7497, 2012
822012
Benchmarking density functionals on structural parameters of small-/medium-sized organic molecules
É Brémond, M Savarese, NQ Su, ÁJ Pérez-Jiménez, X Xu, ...
Journal of chemical theory and computation 12 (2), 459-465, 2016
772016
Functionalized Graphene as an Electron‐Cascade Acceptor for Air‐Processed Organic Ternary Solar Cells
F Bonaccorso, N Balis, MM Stylianakis, M Savarese, C Adamo, M Gemmi, ...
Advanced Functional Materials 25 (25), 3870-3880, 2015
762015
Exploring excited states using time dependent density functional theory and density-based indexes
C Adamo, T Le Bahers, M Savarese, L Wilbraham, G García, R Fukuda, ...
Coordination Chemistry Reviews 304, 166-178, 2015
702015
Exploring the metric of excited state proton transfer reactions
M Savarese, PA Netti, C Adamo, N Rega, I Ciofini
The Journal of Physical Chemistry B 117 (50), 16165-16173, 2013
502013
Describing excited state intramolecular proton transfer in dual emissive systems: a density functional theory based analysis
L Wilbraham, M Savarese, N Rega, C Adamo, I Ciofini
The Journal of Physical Chemistry B 119 (6), 2459-2466, 2015
392015
Intermolecular proton shuttling in excited state proton transfer reactions: insights from theory
M Savarese, PA Netti, N Rega, C Adamo, I Ciofini
Physical Chemistry Chemical Physics 16 (18), 8661-8666, 2014
342014
Non-radiative decay paths in rhodamines: new theoretical insights
M Savarese, U Raucci, C Adamo, PA Netti, I Ciofini, N Rega
Physical Chemistry Chemical Physics 16 (38), 20681-20688, 2014
302014
Studies on the enantioselective iminium ion trapping of radicals triggered by an electron-relay mechanism
A Bahamonde, JJ Murphy, M Savarese, E Brémond, A Cavalli, ...
Journal of the American Chemical Society 139 (12), 4559-4567, 2017
282017
Intrinsic and dynamical reaction pathways of an excited state proton transfer
U Raucci, M Savarese, C Adamo, I Ciofini, N Rega
The Journal of Physical Chemistry B 119 (6), 2650-2657, 2015
262015
Importance of orbital optimization for double-hybrid density functionals: application of the OO-PBE-QIDH model for closed-and open-shell systems
JC Sancho-Garcia, AJ Pérez-Jiménez, M Savarese, E Brémond, C Adamo
The Journal of Physical Chemistry A 120 (10), 1756-1762, 2016
232016
Accuracy of TD-DFT Geometries: A Fresh Look
E Bremond, M Savarese, C Adamo, D Jacquemin
Journal of chemical theory and computation 14 (7), 3715-3727, 2018
212018
Metrics for molecular electronic excitations: A comparison between orbital-and density-based descriptors
M Savarese, CA Guido, E Bremond, I Ciofini, C Adamo
The Journal of Physical Chemistry A 121 (40), 7543-7549, 2017
202017
Systematic improvement of density functionals through parameter-free hybridization schemes
E Bremond, M Savarese, ÁJ Pérez-Jiménez, JC Sancho-García, C Adamo
The journal of physical chemistry letters 6 (18), 3540-3545, 2015
202015
Quadratic integrand double-hybrid made spin-component-scaled
É Brémond, M Savarese, JC Sancho-García, ÁJ Pérez-Jiménez, C Adamo
The Journal of chemical physics 144 (12), 124104, 2016
192016
A qualitative model to identify non-radiative decay channels: the spiropyran as case study
M Savarese, U Raucci, PA Netti, C Adamo, N Rega, I Ciofini
Theoretical Chemistry Accounts 135 (9), 211, 2016
182016
Modeling of charge transfer processes to understand photophysical signatures: The case of Rhodamine 110
M Savarese, U Raucci, PA Netti, C Adamo, I Ciofini, N Rega
Chemical Physics Letters 610, 148-152, 2014
172014
Controlled tautomeric switching in azonaphthols tuned by substituents on the phenyl ring
L Antonov, V Deneva, S Simeonov, V Kurteva, A Crochet, KM Fromm, ...
ChemPhysChem 16 (3), 649-657, 2015
152015
Exploring the limits of recent exchange–correlation functionals in modeling lithium/benzene interaction
M Savarese, E Bremond, C Adamo
Theoretical Chemistry Accounts 135 (4), 99, 2016
142016
Speed-up of the excited-state benchmarking: Double-hybrid density functionals as test cases
É Brémond, M Savarese, ÁJ Pérez-Jiménez, JC Sancho-García, C Adamo
Journal of chemical theory and computation 13 (11), 5539-5551, 2017
132017
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