| An In Situ Surface-Enhanced Infrared Absorption Spectroscopy Study of Electrochemical CO2 Reduction: Selectivity Dependence on Surface C-Bound and O … Y Katayama, F Nattino, L Giordano, J Hwang, RR Rao, O Andreussi, ... The Journal of Physical Chemistry C 123 (10), 5951-5963, 2018 | 177 | 2018 |
| Ab Initio Molecular Dynamics Calculations versus Quantum-State-Resolved Experiments on CHD3 + Pt(111): New Insights into a Prototypical Gas–Surface Reaction F Nattino, H Ueta, H Chadwick, ME van Reijzen, RD Beck, B Jackson, ... The journal of physical chemistry letters 5 (8), 1294-1299, 2014 | 139 | 2014 |
| Effect of surface motion on the rotational quadrupole alignment parameter of D 2 reacting on Cu (111) F Nattino, C Díaz, B Jackson, GJ Kroes Physical review letters 108 (23), 236104, 2012 | 128 | 2012 |
| Chemically accurate simulation of a polyatomic molecule-metal surface reaction F Nattino, D Migliorini, GJ Kroes, E Dombrowski, EA High, DR Killelea, ... The Journal of Physical Chemistry Letters 7 (13), 2402-2406, 2016 | 119 | 2016 |
| Dissociative chemisorption of methane on metal surfaces: tests of dynamical assumptions using quantum models and ab initio molecular dynamics B Jackson, F Nattino, GJ Kroes The Journal of Chemical Physics 141 (5), 2014 | 91 | 2014 |
| Surface reaction barriometry: methane dissociation on flat and stepped transition-metal surfaces D Migliorini, H Chadwick, F Nattino, A Gutiérrez-González, E Dombrowski, ... The journal of physical chemistry letters 8 (17), 4177-4182, 2017 | 88 | 2017 |
| Continuum models of the electrochemical diffuse layer in electronic-structure calculations F Nattino, M Truscott, N Marzari, O Andreussi The Journal of chemical physics 150 (4), 2019 | 79 | 2019 |
| Methane dissociation on Pt (111): Searching for a specific reaction parameter density functional F Nattino, D Migliorini, M Bonfanti, GJ Kroes The Journal of Chemical Physics 144 (4), 2016 | 61 | 2016 |
| Solvent-aware interfaces in continuum solvation O Andreussi, NG Hormann, F Nattino, G Fisicaro, S Goedecker, N Marzari Journal of chemical theory and computation 15 (3), 1996-2009, 2019 | 53 | 2019 |
| Dissociation and recombination of D2 on Cu (111): Ab initio molecular dynamics calculations and improved analysis of desorption experiments F Nattino, A Genova, M Guijt, AS Muzas, C Díaz, DJ Auerbach, GJ Kroes The Journal of Chemical Physics 141 (12), 2014 | 46 | 2014 |
| Dissociative chemisorption of methane on Ni (111) using a chemically accurate fifteen dimensional potential energy surface X Zhou, F Nattino, Y Zhang, J Chen, GJ Kroes, H Guo, B Jiang Physical Chemistry Chemical Physics 19 (45), 30540-30550, 2017 | 41 | 2017 |
| Fast and credible likelihood-free cosmology with truncated marginal neural ratio estimation A Cole, BK Miller, SJ Witte, MX Cai, MW Grootes, F Nattino, C Weniger Journal of Cosmology and Astroparticle Physics 2022 (09), 004, 2022 | 36 | 2022 |
| Rotational effects on the dissociation dynamics of CHD 3 on Pt (111) G Füchsel, PS Thomas, J den Uyl, Y Öztürk, F Nattino, HD Meyer, ... Physical Chemistry Chemical Physics 18 (11), 8174-8185, 2016 | 28 | 2016 |
| Modeling surface motion effects in N2 dissociation on W (110): Ab initio molecular dynamics calculations and generalized Langevin oscillator model F Nattino, O Galparsoro, F Costanzo, R Díez Muiño, M Alducin, GJ Kroes The Journal of Chemical Physics 144 (24), 2016 | 24 | 2016 |
| N2 dissociation on W (110): An ab initio molecular dynamics study on the effect of phonons F Nattino, F Costanzo, GJ Kroes The Journal of Chemical Physics 142 (10), 2015 | 24 | 2015 |
| Operando XANES from first-principles and its application to iridium oxide F Nattino, N Marzari Physical Chemistry Chemical Physics 22 (19), 10807-10818, 2020 | 18 | 2020 |
| Better together? Assessing different remote sensing products for predicting habitat suitability of wetland birds Z Koma, AC Seijmonsbergen, MW Grootes, F Nattino, J Groot, ... Diversity and distributions 28 (4), 685-699, 2022 | 17 | 2022 |
| Role of OH intermediates during the Au oxide electro-reduction at low pH elucidated by electrochemical surface-enhanced Raman spectroscopy and implicit solvent density … JHK Pfisterer, F Nattino, UE Zhumaev, M Breiner, JM Feliu, N Marzari, ... ACS catalysis 10 (21), 12716-12726, 2020 | 17 | 2020 |
| swyft: Truncated marginal neural ratio estimation in python BK Miller, A Cole, C Weniger, F Nattino, O Ku, MW Grootes Journal of Open Source Software 7 (75), 4205, 2022 | 15 | 2022 |
| Application of van der Waals functionals to the calculation of dissociative adsorption of N2 on W (110) for static and dynamic systems D Migliorini, F Nattino, GJ Kroes The Journal of Chemical Physics 144 (8), 2016 | 14 | 2016 |
