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Biancardi Alessandro
Biancardi Alessandro
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Year
What is solvatochromism?
A Marini, A Munoz-Losa, A Biancardi, B Mennucci
The Journal of Physical Chemistry B 114 (51), 17128-17135, 2010
5202010
Polarity-Sensitive Fluorescent Probes in Lipid Bilayers: Bridging Spectroscopic Behavior and Microenvironment Properties
G Parisio, A Marini, A Biancardi, A Ferrarini, B Mennucci
The Journal of Physical Chemistry B 115 (33), 9980-9989, 2011
642011
An investigation of the photophysical properties of minor groove bound and intercalated DAPI through quantum-mechanical and spectroscopic tools
A Biancardi, T Biver, F Secco, B Mennucci
Physical Chemistry Chemical Physics 15 (13), 4596-4603, 2013
622013
Accurate and inexpensive prediction of the color optical properties of anthocyanins in solution
X Ge, I Timrov, S Binnie, A Biancardi, A Calzolari, S Baroni
The Journal of Physical Chemistry A 119 (16), 3816-3822, 2015
552015
Thiazole orange (TO) as a light-switch probe: a combined quantum-mechanical and spectroscopic study
A Biancardi, T Biver, A Marini, B Mennucci, F Secco
Physical Chemistry Chemical Physics 13 (27), 12595-12602, 2011
542011
Mechanistic aspects of thioflavin-T self-aggregation and DNA binding: evidence for dimer attack on DNA grooves
A Biancardi, T Biver, A Burgalassi, M Mattonai, F Secco, M Venturini
Physical Chemistry Chemical Physics 16 (37), 20061-20072, 2014
532014
Plasmon-controlled light-harvesting: design rules for biohybrid devices via multiscale modeling
O Andreussi, A Biancardi, S Corni, B Mennucci
Nano letters 13 (9), 4475-4484, 2013
432013
Simulations of Ammonia Adsorption for the Characterization of Acid Sites in Metal-Doped Amorphous Silicates
AM Jystad, A Biancardi, M Caricato
The Journal of Physical Chemistry C 121 (40), 22258-22267, 2017
282017
A Theoretical and Experimental Investigation of the Spectroscopic Properties of a DNA‐Intercalator Salphen‐Type ZnII Complex
A Biancardi, A Burgalassi, A Terenzi, A Spinello, G Barone, T Biver, ...
Chemistry–A European Journal 20 (24), 7439-7447, 2014
272014
Self-consistent continuum solvation for optical absorption of complex molecular systems in solution
I Timrov, O Andreussi, A Biancardi, N Marzari, S Baroni
The Journal of chemical physics 142 (3), 034111, 2015
242015
Correlation Of Active Site Precursors And Olefin Metathesis Activity In W-Incorporated Silicates
JF Wu, A Ramanathan, A Biancardi, AM Jystad, M Caricato, Y Hu, ...
ACS Catalysis 8 (11), 10437-10445, 2018
202018
Fluorescent dyes in the context of DNA‐binding: The case of Thioflavin T
A Biancardi, T Biver, B Mennucci
International Journal of Quantum Chemistry 117 (8), e25349, 2017
202017
Point charge embedding for ONIOM excited states calculations
A Biancardi, J Barnes, M Caricato
The Journal of Chemical Physics 145 (22), 224109, 2016
162016
Modelling vibrational coupling in DNA oligomers: a computational strategy combining QM and continuum solvation models
A Biancardi, R Cammi, C Cappelli, B Mennucci, J Tomasi
Theoretical Chemistry Accounts 131 (3), 1157, 2012
162012
Catalytic N−H Bond Activation and Breaking by a Well‐Defined CoII1O4 Site of a Heterogeneous Catalyst
K Khivantsev, A Biancardi, M Fathizadeh, F Almalki, JL Grant, HN Tien, ...
ChemCatChem 10 (4), 736-742, 2018
122018
Evaluation of Electronic Coupling in Solids from Ab Initio Periodic Boundary Condition Calculations: The Case of Pentacene Crystal and Bilayer Graphene
A Biancardi, M Caricato
The Journal of Physical Chemistry C 120 (32), 17939-17948, 2016
112016
A Benchmark Study of Electronic Couplings in Donor–Bridge–Acceptor Systems with the FMR-B Method
A Biancardi, M Caricato
Journal of chemical theory and computation 14 (4), 2007-2016, 2018
72018
Electronic Coupling for Donor-Bridge-Acceptor Systems with a Bridge-Overlap Approach
A Biancardi, SC Martin, C Liss, M Caricato
Journal of chemical theory and computation 13 (9), 4154-4161, 2017
72017
How the number of layers and relative position modulate the interlayer electron transfer in π-stacked 2D materials
A Biancardi, C Caraiani, WL Chan, M Caricato
The Journal of Physical Chemistry Letters 8 (7), 1365-1370, 2017
72017
Toward a Quantum-Mechanical Description of 2D-IR Spectra of Solvated Systems: The Vibrational Mode Coupling within A Polarizable Continuum Model
A Biancardi, C Cappelli, B Mennucci, R Cammi
The Journal of Physical Chemistry B 114 (14), 4924-4930, 2010
72010
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