Imperial College London

Dr Clotilde S. Cucinotta

Faculty of Natural SciencesDepartment of Chemistry

EPSRC Fellow



+44 (0)20 7594 1169c.cucinotta




110KMolecular Sciences Research HubWhite City Campus





Computational NanoElectrochemistry Group

The group's research interests focus on quantum mechanical modelling of materials and electrochemical (EC) processes at the nanoscale. The team currently works to develop a new methodology to simulate EC devices – such as fuel and solar cells, batteries, supercapacitors and sensors - in operation, including the effect of applied potential and electric currents. They use this to study problems like EC corrosion, water splitting, redox switching and current induced effects at nanointerfaces. 

Dr. Cucinotta joined the Department of Chemistry at Imperial College London in 2018 with an independent fellowship funded by EPSRC.  She moved to Imperial from the School of Physics at Trinity College Dublin (IE), where she undertook investigations of different electron transport problems at interfaces and in molecular junctions, and  developed new models for environmental stability and chemical reactivity of 2D materials.  Previously, she worked at  ETHZ (CH), where she pioneered novel molecular dynamics techniques to model chemical transformation and mass diffusion in solids and liquids, and matured an interest for the energy problem, studying Hydrogen storage and energy conversion in SOFCs. Following her master in Condensed Matter Physics at University of Messina (IT), Dr. Cucinotta was awarded a PhD from University of Modena and the excellence centre INFM-CNR-S3 (IT); her doctoral research activity focused on the theoretical modelling of self-assembly and semiconductor surfaces' functionalization with organic molecules.


Postdoctoral research associate in development of computational methods for nanoelectrochemistry

Postdoctoral research associate in computational modelling of electrochemical interfaces at the nanoscale



Long E, O’Brien S, Lewis EA, et al., 2017, An in situ and ex situ TEM study into the oxidation of titanium (IV) sulphide, Npj 2d Materials and Applications, Vol:1, ISSN:2397-7132

Bai M, Cucinotta CS, Jiang Z, et al., 2016, Current-induced phonon renormalization in molecular junctions, Phys. Rev. B, Vol:94, Pages:035411-035411

Hanlon D, Backes C, Doherty E, et al., 2015, Liquid exfoliation of solvent-stabilized few-layer black phosphorus for applications beyond electronics, Nature Communications, Vol:6, ISSN:2041-1723, Pages:1-11

Cucinotta CS, Dolui K, Pettersson H, et al., 2015, Electronic Properties and Chemical Reactivity of TiS2 Nanoflakes, Journal of Physical Chemistry C, Vol:119, ISSN:1932-7447, Pages:15707-15715

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