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Andrea Cepellotti
Andrea Cepellotti
Harvard University, School of Engineering and Applied Sciences
E-mail confirmado em g.harvard.edu
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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
18032018
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
6422016
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
6342014
Phonon hydrodynamics in two-dimensional materials
A Cepellotti, G Fugallo, L Paulatto, M Lazzeri, F Mauri, N Marzari
Nature communications 6 (1), 6400, 2015
5662015
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
2792020
Thermal transport in crystals as a kinetic theory of relaxons
A Cepellotti, N Marzari
Physical Review X 6 (4), 041013, 2016
1682016
Perspective on ab initio phonon thermal transport
L Lindsay, A Katre, A Cepellotti, N Mingo
Journal of Applied Physics 126 (5), 2019
1172019
Generalization of Fourier’s law into viscous heat equations
M Simoncelli, N Marzari, A Cepellotti
Physical Review X 10 (1), 011019, 2020
1052020
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
692019
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
662021
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
662016
Boltzmann transport in nanostructures as a friction effect
A Cepellotti, N Marzari
Nano letters 17 (8), 4675-4682, 2017
572017
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
332022
Transport waves as crystal excitations
A Cepellotti, N Marzari
Physical Review Materials 1 (4), 045406, 2017
292017
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
272017
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
152013
Interband tunneling effects on materials transport properties using the first principles Wigner distribution
A Cepellotti, B Kozinsky
Materials Today Physics 19, 100412, 2021
142021
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
122013
On the Kinetic Theory of Thermal Transport in Crystals
A Cepellotti, N Marzari
Handbook of Materials Modeling: Applications: Current and Emerging Materials …, 2020
12020
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