Gabriele Sclauzero
Gabriele Sclauzero
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Cited by
Cited by
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
J. phys.: condens. matter
P Giannozzi, S Baroni, N Bonini, M Calandra, R Car, C Cavazzoni, ...
mar 21, 395502, 2009
Infrared spectra of jennite and tobermorite from first-principles
A Vidmer, G Sclauzero, A Pasquarello
Cement and concrete research 60, 11-23, 2014
Carbon rehybridization at the graphene/SiC (0001) interface: Effect on stability and atomic-scale corrugation
G Sclauzero, A Pasquarello
Physical Review B 85 (16), 161405, 2012
Tuning the metal-insulator transition in d 1 and d 2 perovskites by epitaxial strain: A first-principles-based study
G Sclauzero, K Dymkowski, C Ederer
Physical Review B 94 (24), 245109, 2016
Interaction of a CO molecule with a Pt monatomic wire: Electronic structure and ballistic conductance
G Sclauzero, A Dal Corso, A Smogunov, E Tosatti
Physical Review B 78 (8), 085421, 2008
Structural and electronic properties of epitaxially strained LaVO 3 from density functional theory and dynamical mean-field theory
G Sclauzero, C Ederer
Physical Review B 92 (23), 235112, 2015
Efficient DFT+ U calculations of ballistic electron transport: Application to Au monatomic chains with a CO impurity
G Sclauzero, A Dal Corso
Physical Review B 87 (8), 085108, 2013
Interaction of CO with an Au monatomic chain at different strains: Electronic structure and ballistic transport
G Sclauzero, A Dal Corso, A Smogunov
Physical Review B 85 (16), 165411, 2012
Stability and charge transfer at the interface between SiC (0 0 0 1) and epitaxial graphene
G Sclauzero, A Pasquarello
Microelectronic engineering 88 (7), 1478-1481, 2011
Metal-insulator transition in thin films: Interplay between epitaxial strain, dimensional confinement, and surface effects
S Beck, G Sclauzero, U Chopra, C Ederer
Physical Review B 97 (7), 075107, 2018
Low-strain interface models for epitaxial graphene on SiC (0001)
G Sclauzero, A Pasquarello
Diamond and related materials 23, 178-183, 2012
Giant apparent lattice distortions in STM images of corrugated sp2-hybridised monolayers
Q Dubout, F Calleja, G Sclauzero, M Etzkorn, A Lehnert, L Claude, ...
New Journal of Physics 18 (10), 103027, 2016
Effect of stretching on the ballistic conductance of Au nanocontacts in presence of CO: A density functional study
G Sclauzero, A Dal Corso, A Smogunov
Physical Review B 85 (16), 165412, 2012
Intercalation of H at the graphene/SiC (0001) interface: Structure and stability from first principles
G Sclauzero, A Pasquarello
Applied surface science 291, 64-68, 2014
First‐principles study of H adsorption on graphene/SiC (0001)
G Sclauzero, A Pasquarello
physica status solidi (b) 250 (12), 2523-2528, 2013
QE: Quantum opEn-Source Package for Research in Electronic Structure, Simulation, and Optimization
P Giannozzi, O Andreussi, S Baroni, N Bonini, T Brumme, O Bunau, ...
Astrophysics Source Code Library, ascl: 1806.006, 2018
DFT+DMFT study of strain and interface effects in d1 and d2 t2 g-perovskites
G Sclauzero, K Dymkowski, C Ederer
APS March Meeting Abstracts 2015, T13. 013, 2015
Modeling CO adsorption on Pt and Au monatomic chains and nanocontacts
G Sclauzero
SISSA, 2010
Interaction of a CO molecule with a Pt monoatomic chain: the top geometry
G Sclauzero, A Dal Corso, A Smogunov, E Tosatti
AIP Conference Proceedings 1018, 201-204, 2008
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