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
579 1999 Coexistence of tetrahedral-and octahedral-like sites in amorphous phase change materials S Caravati, M Bernasconi, TD Kühne, M Krack, M Parrinello
Applied Physics Letters 91 (17), 2007
450 2007 Ab initio infrared spectrum of liquid water PL Silvestrelli, M Bernasconi, M Parrinello
Chemical Physics Letters 277 (5-6), 478-482, 1997
412 1997 Ab initio study of structural and electronic properties of yttria-stabilized cubic zirconia G Stapper, M Bernasconi, N Nicoloso, M Parrinello
Physical Review B 59 (2), 797, 1999
354 1999 Two dimensional ice adsorbed on mica surface M Odelius, M Bernasconi, M Parrinello
Physical Review Letters 78 (14), 2855, 1997
348 1997 Neural network interatomic potential for the phase change material GeTe GC Sosso, G Miceli, S Caravati, J Behler, M Bernasconi
Physical Review B—Condensed Matter and Materials Physics 85 (17), 174103, 2012
276 2012 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
247 1995 Ab initio molecular-dynamics simulation of LM Ramaniah, M Bernasconi, M Parrinello
The Journal of chemical physics 111 (4), 1587-1591, 1999
219 1999 New high-pressure phase of ice M Benoit, M Bernasconi, P Focher, M Parrinello
Physical review letters 76 (16), 2934, 1996
216 1996 First-principles study of crystalline and amorphous Ge2Sb2Te5 and the effects of stoichiometric defects S Caravati, M Bernasconi, TD Kühne, M Krack, M Parrinello
Journal of Physics: Condensed Matter 21 (25), 255501, 2009
211 2009 Vibrational properties of crystalline Sb2Te3 from first principles GC Sosso, S Caravati, M Bernasconi
Journal of Physics: Condensed Matter 21 (9), 095410, 2009
211 2009 Microscopic structure of tetrahedral amorphous carbon NA Marks, DR McKenzie, BA Pailthorpe, M Bernasconi, M Parrinello
Physical review letters 76 (5), 768, 1996
208 1996 Signature of tetrahedral Ge in the Raman spectrum of amorphous phase-change materials R Mazzarello, S Caravati, S Angioletti-Uberti, M Bernasconi, M Parrinello
Physical review letters 104 (8), 085503, 2010
196 2010 Ab initio calculations of structural and electronic properties of gallium solid-state phases M Bernasconi, GL Chiarotti, E Tosatti
Physical Review B 52 (14), 9988, 1995
196 1995 Ab initio simulations of tetrahedral amorphous carbon NA Marks, DR McKenzie, BA Pailthorpe, M Bernasconi, M Parrinello
Physical Review B 54 (14), 9703, 1996
190 1996 Structural phase transformations via first-principles simulation P Focher, GL Chiarotti, M Bernasconi, E Tosatti, M Parrinello
Europhysics Letters 26 (5), 345, 1994
190 1994 Ab initio infrared absorption study of the hydrogen-bond symmetrization in ice M Bernasconi, PL Silvestrelli, M Parrinello
Physical review letters 81 (6), 1235, 1998
188 1998 Ab initio study of the vibrational properties of crystalline M Ceriotti, F Pietrucci, M Bernasconi
Physical Review B—Condensed Matter and Materials Physics 73 (10), 104304, 2006
182 2006 Two-membered silicon rings on the dehydroxylated surface of silica D Ceresoli, M Bernasconi, S Iarlori, M Parrinello, E Tosatti
Physical review letters 84 (17), 3887, 2000
179 2000 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 