| Atomistic details of oxide surfaces and surface oxidation: the example of copper and its oxides C Gattinoni, A Michaelides Surface Science Reports 70 (3), 424-447, 2015 | 360 | 2015 |
| Piezoelectrically enhanced photocatalysis with BiFeO3 nanostructures for efficient water remediation F Mushtaq, X Chen, M Hoop, H Torlakcik, E Pellicer, J Sort, C Gattinoni, ... iscience 4, 236-246, 2018 | 282 | 2018 |
| 2D supramolecular assemblies of benzene-1, 3, 5-triyl-tribenzoic acid: Temperature-induced phase transformations and hierarchical organization with macrocyclic molecules M Ruben, D Payer, A Landa, A Comisso, C Gattinoni, N Lin, JP Collin, ... Journal of the American Chemical Society 128 (49), 15644-15651, 2006 | 240 | 2006 |
| A comparison of classical force-fields for molecular dynamics simulations of lubricants JP Ewen, C Gattinoni, FM Thakkar, N Morgan, HA Spikes, D Dini Materials 9 (8), 651, 2016 | 138 | 2016 |
| Nonequilibrium molecular dynamics simulations of organic friction modifiers adsorbed on iron oxide surfaces JP Ewen, C Gattinoni, N Morgan, HA Spikes, D Dini Langmuir 32 (18), 4450-4463, 2016 | 137 | 2016 |
| Understanding corrosion inhibition with van der Waals DFT methods: the case of benzotriazole C Gattinoni, A Michaelides Faraday discussions 180, 439-458, 2015 | 88 | 2015 |
| On the effect of confined fluid molecular structure on nonequilibrium phase behaviour and friction JP Ewen, C Gattinoni, J Zhang, DM Heyes, HA Spikes, D Dini Physical Chemistry Chemical Physics 19 (27), 17883-17894, 2017 | 66 | 2017 |
| Nonequilibrium molecular dynamics investigation of the reduction in friction and wear by carbon nanoparticles between iron surfaces JP Ewen, C Gattinoni, FM Thakkar, N Morgan, HA Spikes, D Dini Tribology letters 63, 1-15, 2016 | 64 | 2016 |
| Traction and nonequilibrium phase behavior of confined sheared liquids at high pressure C Gattinoni, DM Heyes, CD Lorenz, D Dini Physical Review E—Statistical, Nonlinear, and Soft Matter Physics 88 (5 …, 2013 | 53 | 2013 |
| Adsorption of Surfactants on α-Fe2O3(0001): A Density Functional Theory Study C Gattinoni, JP Ewen, D Dini The Journal of Physical Chemistry C 122 (36), 20817-20826, 2018 | 50 | 2018 |
| Depolarizing-field effects in epitaxial capacitor heterostructures N Strkalj, G De Luca, M Campanini, S Pal, J Schaab, C Gattinoni, ... Physical review letters 123 (14), 147601, 2019 | 48 | 2019 |
| Water (Non-)Interaction with MoO3 AR Head, C Gattinoni, L Trotochaud, Y Yu, O Karslıoğlu, S Pletincx, ... The Journal of Physical Chemistry C 123 (27), 16836-16842, 2019 | 48 | 2019 |
| Interface and surface stabilization of the polarization in ferroelectric thin films C Gattinoni, N Strkalj, R Härdi, M Fiebig, M Trassin, NA Spaldin Proceedings of the National Academy of Sciences 117 (46), 28589-28595, 2020 | 44 | 2020 |
| Magnetoelectric effect in hydrogen harvesting: magnetic field as a trigger of catalytic reactions D Kim, I Efe, H Torlakcik, A Terzopoulou, A Veciana, E Siringil, F Mushtaq, ... Advanced Materials 34 (19), 2110612, 2022 | 41 | 2022 |
| Water–ice analogues of polycyclic aromatic hydrocarbons: water nanoclusters on Cu (111) ML Liriano, C Gattinoni, EA Lewis, CJ Murphy, ECH Sykes, A Michaelides Journal of the American Chemical Society 139 (18), 6403-6410, 2017 | 38 | 2017 |
| Simulating surfactant–iron oxide interfaces: from density functional theory to molecular dynamics CA Latorre, JP Ewen, C Gattinoni, D Dini The Journal of Physical Chemistry B 123 (31), 6870-6881, 2019 | 37 | 2019 |
| Substituent effects on the thermal decomposition of phosphate esters on ferrous surfaces JP Ewen, CA Latorre, C Gattinoni, A Khajeh, JD Moore, JE Remias, ... The Journal of Physical Chemistry C 124 (18), 9852-9865, 2020 | 34 | 2020 |
| Ab initio based multiscale modelling for materials science G Makov, C Gattinoni, A De Vita Modelling and Simulation in Materials Science and Engineering 17 (8), 084008, 2009 | 31 | 2009 |
| Layer and spontaneous polarizations in perovskite oxides and their interplay in multiferroic bismuth ferrite NA Spaldin, I Efe, MD Rossell, C Gattinoni The Journal of Chemical Physics 154 (15), 2021 | 28 | 2021 |
| Strain relief during ice growth on a hexagonal template N Gerrard, C Gattinoni, F McBride, A Michaelides, A Hodgson Journal of the American Chemical Society 141 (21), 8599-8607, 2019 | 27 | 2019 |
