Riccardo Alessandri
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Enhancing Molecular n‐Type Doping of Donor–Acceptor Copolymers by Tailoring Side Chains
J Liu, L Qiu, R Alessandri, X Qiu, G Portale, JJ Dong, W Talsma, G Ye, ...
Advanced Materials 30 (7), 1704630, 2018
Bulk heterojunction morphologies with atomistic resolution from coarse-grain solvent evaporation simulations
R Alessandri, JJ Uusitalo, AH De Vries, RWA Havenith, SJ Marrink
Journal of the American Chemical Society 139 (10), 3697-3705, 2017
Pitfalls of the Martini model
R Alessandri, PCT Souza, S Thallmair, MN Melo, AH De Vries, SJ Marrink
Journal of chemical theory and computation 15 (10), 5448-5460, 2019
Enhancing doping efficiency by improving host-dopant miscibility for fullerene-based n-type thermoelectrics
L Qiu, J Liu, R Alessandri, X Qiu, M Koopmans, RWA Havenith, ...
Journal of Materials Chemistry A 5 (40), 21234-21241, 2017
Protein–ligand binding with the coarse-grained Martini model
PCT Souza, S Thallmair, P Conflitti, C Ramírez-Palacios, R Alessandri, ...
Nature communications 11 (1), 1-11, 2020
Martini 3: a general purpose force field for coarse-grained molecular dynamics
PCT Souza, R Alessandri, J Barnoud, S Thallmair, I Faustino, ...
Nature methods 18 (4), 382-388, 2021
N-type organic thermoelectrics: demonstration of ZT> 0.3
J Liu, B van der Zee, R Alessandri, S Sami, J Dong, MI Nugraha, ...
Nature communications 11 (1), 1-9, 2020
Can the dielectric constant of fullerene derivatives be enhanced by side-chain manipulation? A predictive first-principles computational study
S Sami, PAB Haase, R Alessandri, R Broer, RWA Havenith
The Journal of Physical Chemistry A 122 (15), 3919-3926, 2018
Crystal field in rare‐earth complexes: From electrostatics to bonding
R Alessandri, H Zulfikri, J Autschbach, H Bolvin
Chemistry-A European Journal, 2018
Resolving donor–acceptor interfaces and charge carrier energy levels of organic semiconductors with polar side chains
R Alessandri, S Sami, J Barnoud, AH de Vries, SJ Marrink, RWA Havenith
Advanced Functional Materials 30 (46), 2004799, 2020
How ethylene glycol chains enhance the dielectric constant of organic semiconductors: molecular origin and frequency dependence
S Sami, R Alessandri, R Broer, RWA Havenith
ACS applied materials & interfaces 12 (15), 17783-17789, 2020
Molecular versus excitonic disorder in individual artificial light-harvesting systems
B Kriete, AS Bondarenko, R Alessandri, I Patmanidis, VV Krasnikov, ...
Journal of the American Chemical Society 142 (42), 18073-18085, 2020
Multiscale modeling of molecular structure and optical properties of complex supramolecular aggregates
AS Bondarenko, I Patmanidis, R Alessandri, PCT Souza, TLC Jansen, ...
Chemical science 11 (42), 11514-11524, 2020
The martini model in materials science
R Alessandri, F Grünewald, SJ Marrink
Advanced Materials, 2008635, 2021
Multiscale Modeling of Organic Materials: from the Morphology Up
R Alessandri
University of Groningen, https://doi.org/10.33612/diss.98150035, 2019
Polyply: a python suite for facilitating simulations of (bio-) macromolecules and nanomaterials
F Grünewald, R Alessandri, PC Kroon, L Monticelli, PCT Souza, ...
arXiv preprint arXiv:2105.05890, 2021
Martini 3 Coarse-Grained Force Field: Small Molecules
R Alessandri, J Barnoud, AS Gertsen, I Patmanidis, AH de Vries, ...
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