Ab initio study of the phase diagram of epitaxial O Diéguez, S Tinte, A Antons, C Bungaro, JB Neaton, KM Rabe, ... Physical Review B 69 (21), 212101, 2004 | 261 | 2004 |
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 |
Origin of the Relaxor State in Perovskites S Tinte, BP Burton, E Cockayne, UV Waghmare Physical review letters 97 (13), 137601, 2006 | 148 | 2006 |
Surface effects and ferroelectric phase transitions in ultrathin films S Tinte, MG Stachiotti Physical Review B 64 (23), 235403, 2001 | 127 | 2001 |
Anomalous enhancement of tetragonality in induced by negative pressure S Tinte, KM Rabe, D Vanderbilt Physical Review B 68 (14), 144105, 2003 | 120 | 2003 |
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 | 118 | 2004 |
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 | 103 | 1998 |
First-principles-based simulations of relaxor ferroelectrics BP Burton, E Cockayne, S Tinte, UV Waghmare Phase Transitions 79 (1-2), 91-121, 2006 | 94 | 2006 |
Quantitative analysis of the first-principles effective Hamiltonian approach to ferroelectric perovskites S Tinte, J Íñiguez, KM Rabe, D Vanderbilt Physical Review B 67 (6), 064106, 2003 | 67 | 2003 |
Order-disorder, local structure and precursor effects in BaTiO3 S Tinte, MG Stachiotti, M Sepliarsky, RL Migoni, CO Rodriguez Ferroelectrics 237 (1), 41-48, 2000 | 35 | 2000 |
Atomistic simulation of surface effects in S Tinte, MG Stachiotti AIP Conference Proceedings 535 (1), 273-282, 2000 | 32 | 2000 |
Mixed formamidinium–methylammonium lead iodide perovskite from first-principles: hydrogen-bonding impact on the electronic properties M Senno, S Tinte Physical Chemistry Chemical Physics 23 (12), 7376-7385, 2021 | 31 | 2021 |
Phase transitions and antiferroelectricity in from atomic-level simulations M Graf, M Sepliarsky, S Tinte, MG Stachiotti Physical Review B 90 (18), 184108, 2014 | 24 | 2014 |
Vibrational effects on SrTiO3 Ti 1s absorption spectra studied using first-principles methods S Tinte, EL Shirley Journal of Physics: Condensed Matter 20 (36), 365221, 2008 | 21 | 2008 |
Ferroelectric surface induced electron doping in a zigzag graphene nanoribbon GD Belletti, SD Dalosto, S Tinte Journal of Physics: Condensed Matter 28 (43), 435002, 2016 | 14 | 2016 |
Effect of nearest neighbor Pb-O divacancy pairs on the ferroelectric-relaxor transition in BP Burton, E Cockayne, S Tinte, UV Waghmare Physical Review B 77 (14), 144114, 2008 | 14 | 2008 |
Fluctuation Effects of the Electric Field Induced by Water on a Graphene Dot Band Gap SD Dalosto, S Tinte The Journal of Physical Chemistry C 115 (11), 4381-4386, 2011 | 11 | 2011 |
Dynamical behavior of the phase transition of strained BaTiO3 from atomistic simulations M Sepliarsky, S Tinte Physica B: Condensed Matter 404 (18), 2730-2732, 2009 | 10 | 2009 |
Modelling of the phase transitions sequence in KNbO3 and BaTiO3 S Tinte, M Sepliarsky, MG Stachiotti, RL Migoni, CO Rodriguez Zeitschrift für Physik B Condensed Matter 104, 721-724, 1997 | 10 | 1997 |
Strain-gradient-induced switching of nanoscale domains in free-standing ultrathin films GD Belletti, SD Dalosto, S Tinte Physical Review B 89 (17), 174104, 2014 | 9 | 2014 |