Atomistic modelling of BaTiO3 based on first-principles calculations S Tinte, MG Stachiotti, M Sepliarsky, RL Migoni, CO Rodriguez Journal of Physics: Condensed Matter 11 (48), 9679, 1999 | 205 | 1999 |
Atomic-level simulation of ferroelectricity in oxide materials M Sepliarsky, A Asthagiri, SR Phillpot, MG Stachiotti, RL Migoni Current Opinion in Solid State and Materials Science 9 (3), 107-113, 2005 | 157 | 2005 |
Transition Metal Oxide Chemistry: Electronic Structure Study of WO3, ReO3, and NaWO3 F Cora, MG Stachiotti, CRA Catlow, CO Rodriguez The Journal of Physical Chemistry B 101 (20), 3945-3952, 1997 | 157 | 1997 |
Surface effects and ferroelectric phase transitions in ultrathin films S Tinte, MG Stachiotti Physical Review B 64 (23), 235403, 2001 | 127 | 2001 |
Ferroelectric properties of BaxSr1− xTiO3 solid solutions obtained by molecular dynamics simulation S Tinte, MG Stachiotti, SR Phillpot, M Sepliarsky, D Wolf, RL Migoni Journal of Physics: Condensed Matter 16 (20), 3495, 2004 | 119 | 2004 |
Electronic structure and ferroelectricity in MG Stachiotti, CO Rodriguez, C Ambrosch-Draxl, NE Christensen Physical Review B 61 (21), 14434, 2000 | 109 | 2000 |
Applications of the generalized gradient approximation to ferroelectric perovskites S Tinte, MG Stachiotti, CO Rodriguez, DL Novikov, NE Christensen Physical Review B 58 (18), 11959, 1998 | 104 | 1998 |
Long-ranged ferroelectric interactions in perovskite superlattices M Sepliarsky, SR Phillpot, D Wolf, MG Stachiotti, RL Migoni Physical Review B 64 (6), 060101, 2001 | 90 | 2001 |
Toroidal Ferroelectricity in Nanoparticles MG Stachiotti, M Sepliarsky Physical review letters 106 (13), 137601, 2011 | 84 | 2011 |
Ferroelectric properties of superlattices by atomic-level simulation M Sepliarsky, SR Phillpot, D Wolf, MG Stachiotti, RL Migoni Journal of Applied Physics 90 (9), 4509-4519, 2001 | 80 | 2001 |
Crossover from a displacive to an order-disorder transition in the nonlinear-polarizability model M Stachiotti, A Dobry, R Migoni, A Bussmann-Holder Physical Review B 47 (5), 2473, 1993 | 79 | 1993 |
Ferroelectricity in nanoscopic structures MG Stachiotti Applied physics letters 84 (2), 251-253, 2004 | 75 | 2004 |
Ferroelectric phase transitions and dynamical behavior in superlattices by molecular-dynamics simulation M Sepliarsky, SR Phillpot, MG Stachiotti, RL Migoni Journal of applied physics 91 (5), 3165-3171, 2002 | 74 | 2002 |
First-principles investigation of sand related oxides MG Stachiotti, F Corà, CRA Catlow, CO Rodriguez Physical Review B 55 (12), 7508, 1997 | 73 | 1997 |
First-principles determination of ferroelectric instabilities in Aurivillius compounds R Machado, MG Stachiotti, RL Migoni, AH Tera Physical Review B 70 (21), 214112, 2004 | 72 | 2004 |
Atomic-level simulation of ferroelectricity in perovskite solid solutions M Sepliarsky, SR Phillpot, D Wolf, MG Stachiotti, RL Migoni Applied Physics Letters 76 (26), 3986-3988, 2000 | 70 | 2000 |
Lattice polarisation around off-centre Li in LixK1-xTaO3 MG Stachiotti, RL Migoni Journal of Physics: Condensed Matter 2 (19), 4341, 1990 | 70 | 1990 |
Interface Effects in Ferroelectric Ultrathin Films on a Paraelectric Substrate M Sepliarsky, MG Stachiotti, RL Migoni Physical review letters 96 (13), 137603, 2006 | 67 | 2006 |
Surface reconstruction and ferroelectricity in thin films M Sepliarsky, MG Stachiotti, RL Migoni Physical Review B 72 (1), 014110, 2005 | 58 | 2005 |
Structural instabilities in and described by the nonlinear oxygen polarizability model M Sepliarsky, MG Stachiotti, RL Migoni Physical Review B 52 (6), 4044, 1995 | 48 | 1995 |