| A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments S Goedecker, L Genovese, O Andreussi, N Marzari Journal of Chemical Physics 144 (1), 2016 | | 2016 |
| A generalized Poisson and Poisson-Boltzmann solver for electrostatic environments G Fisicaro, L Genovese, O Andreussi, N Marzari, S Goedecker The Journal of chemical physics 144 (1), 2016 | 115 | 2016 |
| A multiscale approach towards additive discovery for natural gas hydrate inhibition and promotion F Bononi, O Andreussi APS March Meeting Abstracts 2022, T02. 009, 2022 | | 2022 |
| Absolute band alignment at semiconductor-water interfaces using explicit and implicit descriptions for liquid water NG Hörmann, Z Guo, F Ambrosio, O Andreussi, A Pasquarello, ... npj Computational Materials 5 (1), 2019 | 28 | 2019 |
| Absolute band alignment at semiconductor-water interfaces using explicit and implicit descriptions for liquid water NG Hörmann, Z Guo, F Ambrosio, O Andreussi, A Pasquarello, N Marzari npj Computational Materials 5 (1), 100, 2019 | 58 | 2019 |
| Activating 2D materials for hydrogen evolution reaction (HER) by electron doping N Karmodak, O Andreussi Bulletin of the American Physical Society 65, 2020 | | 2020 |
| Advanced capabilities for materials modelling with Quantum ESPRESSO P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ... Journal of physics: Condensed matter 29 (46), 465901, 2017 | 7104 | 2017 |
| 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 | 203 | 2018 |
| An Open Source Embedding Code for the Condensed Phase A Genova, D Ceresoli, A Krishtal, O Andreussi, R DiStasio, M Pavanello APS March Meeting Abstracts 2016, E31. 003, 2016 | | 2016 |
| Band alignment at semiconductor-water interfaces using explicit and implicit descriptions for liquid water NG Hörmann, Z Guo, F Ambrosio, O Andreussi, A Pasquarello, N Marzari arXiv preprint arXiv:1904.02039, 2019 | 2 | 2019 |
| Bathochromic Shift in the UV–visible absorption spectra of phenols at ice surfaces: insights from first-principles calculations FC Bononi, Z Chen, D Rocca, O Andreussi, T Hullar, C Anastasio, ... The Journal of Physical Chemistry A 124 (44), 9288-9298, 2020 | 27 | 2020 |
| Breaking the Ice: A First-Principles High-Throughput Approach to Gas Hydrate Inhibition G Miles, O Andreussi, MK Sharif | | 2023 |
| Carotenoids and light-harvesting: from DFT/MRCI to the Tamm–Dancoff approximation O Andreussi, S Knecht, CM Marian, J Kongsted, B Mennucci Journal of chemical theory and computation 11 (2), 655-666, 2015 | 57 | 2015 |
| Catalytic activity and stability of two-dimensional materials for the hydrogen evolution reaction N Karmodak, O Andreussi ACS Energy Letters 5 (3), 885-891, 2020 | 61 | 2020 |
| Catalytic activity of Pt 38 in the oxygen reduction reaction from first-principles simulations L Sementa, O Andreussi, WA Goddard III, A Fortunelli Catalysis Science & Technology 6 (18), 6901-6909, 2016 | 32 | 2016 |
| Characterizing Material Catalytic Abilities Using Chebyshev Polynomials and Radial & Angular Distribution Functions Z Cortright, O Andreussi, J Lu | | 2024 |
| Classical force fields tailored for QM applications: Is it really a feasible strategy? O Andreussi, IG Prandi, M Campetella, G Prampolini, B Mennucci Journal of chemical theory and computation 13 (10), 4636-4648, 2017 | 59 | 2017 |
| Coding solvation: challenges and opportunities L Frediani, O Andreussi, HJ Kulik International Journal of Quantum Chemistry 119 (1), e25839, 2019 | 4 | 2019 |
| Combining classical molecular dynamics and quantum mechanical methods for the description of electronic excitations: the case of carotenoids IG Prandi, L Viani, O Andreussi, B Mennucci Journal of computational chemistry 37 (11), 981-991, 2016 | 46 | 2016 |
| Complex wet-environments in electronic-structure calculations G Fisicaro, L Genovese, O Andreussi, N Marzari, S Goedecker APS March Meeting Abstracts 2016, F53. 007, 2016 | | 2016 |
Nicola MarzariÉcole Polytechnique Fédérale de Lausanne (EPFL), and Paul Scherrer Institut (PSI)Verified email at epfl.ch
