Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds N Mounet, M Gibertini, P Schwaller, D Campi, A Merkys, A Marrazzo, ... Nature nanotechnology 13 (3), 246-252, 2018 | 1650 | 2018 |
AiiDA: automated interactive infrastructure and database for computational science G Pizzi, A Cepellotti, R Sabatini, N Marzari, B Kozinsky Computational Materials Science 111, 218-230, 2016 | 597 | 2016 |
Thermal conductivity of graphene and graphite: collective excitations and mean free paths G Fugallo, A Cepellotti, L Paulatto, M Lazzeri, N Marzari, F Mauri Nano letters 14 (11), 6109-6114, 2014 | 592 | 2014 |
Phonon hydrodynamics in two-dimensional materials A Cepellotti, G Fugallo, L Paulatto, M Lazzeri, F Mauri, N Marzari Nature communications 6 (1), 6400, 2015 | 527 | 2015 |
AiiDA 1.0, a scalable computational infrastructure for automated reproducible workflows and data provenance SP Huber, S Zoupanos, M Uhrin, L Talirz, L Kahle, R Häuselmann, ... Scientific data 7 (1), 300, 2020 | 228 | 2020 |
Thermal transport in crystals as a kinetic theory of relaxons A Cepellotti, N Marzari Physical Review X 6 (4), 041013, 2016 | 157 | 2016 |
Perspective on ab initio phonon thermal transport L Lindsay, A Katre, A Cepellotti, N Mingo Journal of Applied Physics 126 (5), 2019 | 109 | 2019 |
Generalization of Fourier’s law into viscous heat equations M Simoncelli, N Marzari, A Cepellotti Physical Review X 10 (1), 011019, 2020 | 93 | 2020 |
Optomechanical Measurement of Thermal Transport in Two-Dimensional MoSe2 Lattices N Morell, S Tepsic, A Reserbat-Plantey, A Cepellotti, M Manca, I Epstein, ... Nano letters 19 (5), 3143-3150, 2019 | 63 | 2019 |
Rippling ultrafast dynamics of suspended 2D monolayers, graphene J Hu, GM Vanacore, A Cepellotti, N Marzari, AH Zewail Proceedings of the National Academy of Sciences 113 (43), E6555-E6561, 2016 | 60 | 2016 |
Boltzmann transport in nanostructures as a friction effect A Cepellotti, N Marzari Nano letters 17 (8), 4675-4682, 2017 | 56 | 2017 |
Bayesian force fields from active learning for simulation of inter-dimensional transformation of stanene Y Xie, J Vandermause, L Sun, A Cepellotti, B Kozinsky npj Computational Materials 7 (1), 40, 2021 | 55 | 2021 |
A posteriori metadata from automated provenance tracking: integration of AiiDA and TCOD A Merkys, N Mounet, A Cepellotti, N Marzari, S Gražulis, G Pizzi Journal of Cheminformatics 9 (1), 56, 2017 | 26 | 2017 |
Transport waves as crystal excitations A Cepellotti, N Marzari Physical Review Materials 1 (4), 045406, 2017 | 26 | 2017 |
Phoebe: a high-performance framework for solving phonon and electron Boltzmann transport equations A Cepellotti, J Coulter, A Johansson, NS Fedorova, B Kozinsky Journal of Physics: Materials 5 (3), 035003, 2022 | 21 | 2022 |
Accelerating optical absorption spectra and exciton energy computation via interpolative separable density fitting W Hu, M Shao, A Cepellotti, FH da Jornada, L Lin, K Thicke, C Yang, ... International Conference on Computational Science, 604-617, 2018 | 19* | 2018 |
NH3–NO Coadsorption System on Pt(111). I. Structure of the Mixed Layer A Peronio, A Cepellotti, S Marchini, N Abdurakhmanova, C Dri, C Africh, ... The Journal of Physical Chemistry C 117 (41), 21186-21195, 2013 | 15 | 2013 |
Interband tunneling effects on materials transport properties using the first principles Wigner distribution A Cepellotti, B Kozinsky Materials Today Physics 19, 100412, 2021 | 12 | 2021 |
NH3–NO Coadsorption System on Pt(111). II. Intermolecular Interaction A Cepellotti, A Peronio, S Marchini, N Abdurakhmanova, C Dri, C Africh, ... The Journal of Physical Chemistry C 117 (41), 21196-21202, 2013 | 12 | 2013 |
Thermal transport in low dimensions A Cepellotti EPFL, 2016 | 1 | 2016 |