Sandro Scandolo

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Erio TosattiTheoretical Condensed Matter PhysicistVerified email at sissa.it
Guido ChiarottiIN srl, Udine and Politecnico di TorinoVerified email at insrl.eu
Giuseppe E. SantoroProfessor of Condensed Matter Theory at SISSAVerified email at sissa.it
Roberto CarRalph W Dornte Professor in Chemistry, Princeton University Verified email at princeton.edu
Riccardo MazzarelloSapienza UniversityVerified email at uniroma1.it
Roger RousseauPhysical Sciences Directorate, Chemical Sciences Division, Oak Ridge National LabVerified email at ornl.gov
Caetano R MirandaUniversidade de São PauloVerified email at if.usp.br
Javier Antonio Montoya MartinezUniversidad de CartagenaVerified email at unicartagena.edu.co
Liang YunfengThe University of TokyoVerified email at race.u-tokyo.ac.jp
Roberto BiniProfessore Universita di Firenze e LENSVerified email at unifi.it
Marco BernasconiUniversity of Milano-BicoccaVerified email at unimib.it
Giacinto Scoles, FRSAssociate member of NANOTEC & IOM-CNR ITALYVerified email at princeton.edu
Alfredo PasquarelloProfessor of Condensed Matter Physics, EPFLVerified email at epfl.ch
Jorge KohanoffInstituto de Fusion Nuclear, Universidad Politecnica de Madrid, Madrid, SpainVerified email at upm.es
Stefano de GironcoliInternational School for Advanced Studies (SISSA), TriesteVerified email at sissa.it
Eugene GregoryanzProfessor of Physics at Extreme ConditionsVerified email at ed.ac.uk
Mario SantoroResearch Director, National Institute of Optics, INO-CNR, and LENSVerified email at lens.unifi.it
Chrystele SanloupUniversity Pierre and Marie Curie - Paris 6Verified email at upmc.fr
michele parrinelloDepartment of ChemistryVerified email at phys.chem.ethz.ch
Francesca BalettoDepartment of Physics, University of MilanVerified email at unimi.it

Sandro Scandolo

ICTP, Trieste, Italy

Verified email at ictp.it

Physics


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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	30581	2009
Synthesis of Novel Transition Metal Nitrides and AF Young, C Sanloup, E Gregoryanz, S Scandolo, RJ Hemley, H Mao Physical review letters 96 (15), 155501, 2006	584	2006
Superionic and metallic states of water and ammonia at giant planet conditions C Cavazzoni, GL Chiarotti, S Scandolo, E Tosatti, M Bernasconi, ... Science 283 (5398), 44-46, 1999	582	1999
Nonparabolicity and a sum rule associated with bound-to-bound and bound-to-continuum intersubband transitions in quantum wells C Sirtori, F Capasso, J Faist, S Scandolo Physical Review B 50 (12), 8663, 1994	429	1994
Physics of iron at Earth's core conditions A Laio, S Bernard, GL Chiarotti, S Scandolo, E Tosatti Science 287 (5455), 1027-1030, 2000	417	2000
X-ray diffraction and computation yield the structure of alkanethiols on gold (111) A Cossaro, R Mazzarello, R Rousseau, L Casalis, A Verdini, A Kohlmeyer, ... Science 321 (5891), 943-946, 2008	358	2008
An ab initio parametrized interatomic force field for silica P Tangney, S Scandolo The Journal of chemical physics 117 (19), 8898-8904, 2002	289	2002
First-principles codes for computational crystallography in the Quantum-ESPRESSO package S Scandolo, P Giannozzi, C Cavazzoni, S de Gironcoli, A Pasquarello, ... Zeitschrift für Kristallographie-Crystalline Materials 220 (5-6), 574-579, 2005	278	2005
Metal Work-Function Changes Induced by Organic Adsorbates:<? format?> A Combined Experimental and Theoretical Study V De Renzi, R Rousseau, D Marchetto, R Biagi, S Scandolo, ... Physical review letters 95 (4), 046804, 2005	261	2005
Pressure-induced transformation path of graphite to diamond S Scandolo, M Bernasconi, GL Chiarotti, P Focher, E Tosatti Physical Review Letters 74 (20), 4015, 1995	250	1995
Structure of a Monolayer on Au(111) Solved by the Interplay between Molecular Dynamics Calculations and Diffraction Measurements R Mazzarello, A Cossaro, A Verdini, R Rousseau, L Casalis, ... Physical Review Letters 98 (1), 016102, 2007	242	2007
Liquid–liquid phase transition in compressed hydrogen from first-principles simulations S Scandolo Proceedings of the National Academy of Sciences 100 (6), 3051-3053, 2003	222	2003
Dissociation of methane into hydrocarbons at extreme (planetary) pressure and temperature F Ancilotto, GL Chiarotti, S Scandolo, E Tosatti Science 275 (5304), 1288-1290, 1997	204	1997
Amorphous silica-like carbon dioxide M Santoro, FA Gorelli, R Bini, G Ruocco, S Scandolo, WA Crichton Nature 441 (7095), 857-860, 2006	188	2006
Carbon Phase Diagram from Ab Initio Molecular Dynamics X Wang, S Scandolo, R Car Physical review letters 95 (18), 185701, 2005	184	2005
Mechanical strength and coordination defects in compressed silica glass: Molecular dynamics simulations Y Liang, CR Miranda, S Scandolo Physical Review B—Condensed Matter and Materials Physics 75 (2), 024205, 2007	183	2007
First-principle-constant pressure molecular dynamics M Bernasconi, GL Chiarotti, P Focher, S Scandolo, E Tosatti, M Parrinello Journal of Physics and Chemistry of Solids 56 (3-4), 501-505, 1995	176	1995
Thermal conductivity of solid argon from molecular dynamics simulations KV Tretiakov, S Scandolo The Journal of chemical physics 120 (8), 3765-3769, 2004	162	2004
Pressure-induced solid carbonates from molecular CO2 by computer simulation S Serra, C Cavazzoni, GL Chiarotti, S Scandolo, E Tosatti Science 284 (5415), 788-790, 1999	152	1999
Interstitial dinitrogen makes an insulating hard solid AF Young, JA Montoya, C Sanloup, M Lazzeri, E Gregoryanz, S Scandolo Physical Review B—Condensed Matter and Materials Physics 73 (15), 153102, 2006	150	2006

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