QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials P Giannozzi, S Baroni, N Bonini, M Calandra, R Car, C Cavazzoni, ...
Journal of Physics: Condensed Matter 21 (39), 395502, 2009
27834 2009 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
6721 2017 Templated growth of metal–organic coordination chains at surfaces T Classen, G Fratesi, G Costantini, S Fabris, FL Stadler, C Kim, ...
Angewandte Chemie International Edition 44 (38), 6142-6145, 2005
158 2005 Hydrogen and coordination bonding supramolecular structures of trimesic acid on Cu (110) T Classen, M Lingenfelder, Y Wang, R Chopra, C Virojanadara, U Starke, ...
The Journal of Physical Chemistry A 111 (49), 12589-12603, 2007
134 2007 Methane dehydrogenation on Rh@ Cu (111): A first-principles study of a model catalyst A Kokalj, N Bonini, S de Gironcoli, C Sbraccia, G Fratesi, S Baroni
Journal of the American Chemical Society 128 (38), 12448-12454, 2006
69 2006 Electronic States of Silicene Allotropes on Ag (111) PM Sheverdyaeva, SK Mahatha, P Moras, L Petaccia, G Fratesi, G Onida, ...
ACS nano 11 (1), 975-982, 2017
55 2017 Optical response and ultrafast carrier dynamics of the silicene-silver interface E Cinquanta, G Fratesi, S dal Conte, C Grazianetti, F Scotognella, ...
Physical Review B 92 (16), 165427, 2015
48 2015 Analysis of methane-to-methanol conversion on clean and defective Rh surfaces G Fratesi, S de Gironcoli
The Journal of chemical physics 125 (4), 044701, 2006
42 2006 Azimuthal Dichroism in Near-Edge X-ray Absorption Fine Structure Spectra of Planar Molecules G Fratesi, V Lanzilotto, L Floreano, GP Brivio
The Journal of Physical Chemistry C 117 (13), 6632-6638, 2013
40 2013 Atomic corrugation in scanning tunneling microscopy images of the surface A Picone, G Fratesi, A Brambilla, P Sessi, F Donati, S Achilli, L Maini, ...
Physical Review B 81 (11), 115450, 2010
39 2010 High resolution NEXAFS of perylene and PTCDI: a surface science approach to molecular orbital analysis G Fratesi, V Lanzilotto, S Stranges, M Alagia, GP Brivio, L Floreano
Physical Chemistry Chemical Physics 16 (28), 14834-14844, 2014
33 2014 Scanning tunneling microscopy and Raman spectroscopy of polymeric sp–sp 2 carbon atomic wires synthesized on the Au (111) surface A Rabia, F Tumino, A Milani, V Russo, AL Bassi, S Achilli, G Fratesi, ...
Nanoscale 11 (39), 18191-18200, 2019
32 2019 Self-organized chromium oxide monolayers on Fe (001) A Picone, G Fratesi, M Riva, G Bussetti, A Calloni, A Brambilla, MI Trioni, ...
Physical Review B 87 (8), 085403, 2013
31 2013 Two‐Dimensional Silicene–Stanene Heterostructures by Epitaxy DS Dhungana, C Grazianetti, C Martella, S Achilli, G Fratesi, A Molle
Advanced Functional Materials, 2102797, 2021
30 2021 Multiphoton k-resolved photoemission from gold surface states with 800-nm femtosecond laser pulses F Sirotti, N Beaulieu, A Bendounan, MG Silly, C Chauvet, G Malinowski, ...
Physical Review B 90 (3), 035401, 2014
30 2014 Doping Graphene with Substitutional Mn PC Lin, R Villarreal, S Achilli, H Bana, MN Nair, A Tejeda, K Verguts, ...
ACS nano, 2021
29 2021 Femtomagnetism in graphene induced by core level excitation of organic adsorbates A Ravikumar, A Baby, H Lin, GP Brivio, G Fratesi
Scientific reports 6, 24603, 2016
29 2016 Image resonance in the many-body density of states at a metal surface G Fratesi, GP Brivio, P Rinke, RW Godby
Physical Review B 68 (19), 195404, 2003
29 2003 Surface dynamics and friction of K/Cu (001) characterized by helium-3 spin-echo and density functional theory H Hedgeland, PR Kole, HR Davies, AP Jardine, G Alexandrowicz, ...
Physical Review B 80 (12), 125426, 2009
28 2009 Anchoring and Bending of Pentacene on Aluminum (001) A Baby, G Fratesi, SR Vaidya, LL Patera, C Africh, L Floreano, GP Brivio
The Journal of Physical Chemistry C 119 (7), 3624-3633, 2015
27 2015