| The SIESTA method for ab initio order-N materials simulation JM Soler, E Artacho, JD Gale, A García, J Junquera, P Ordejón, ... Journal of Physics: Condensed Matter 14 (11), 2745, 2002 | 12598 | 2002 |
| Critical thickness for ferroelectricity in perovskite ultrathin films J Junquera, P Ghosez Nature 422 (6931), 506-509, 2003 | 1619 | 2003 |
| Numerical atomic orbitals for linear-scaling calculations J Junquera, Ó Paz, D Sánchez-Portal, E Artacho Physical Review B 64 (23), 235111, 2001 | 1185 | 2001 |
| The SIESTA method; developments and applicability E Artacho, E Anglada, O Diéguez, JD Gale, A García, J Junquera, ... Journal of Physics: Condensed Matter 20 (6), 064208, 2008 | 660 | 2008 |
| Ferroelectricity and Tetragonality in Ultrathin Films C Lichtensteiger, JM Triscone, J Junquera, P Ghosez Physical review letters 94 (4), 047603, 2005 | 366 | 2005 |
| Systematic generation of finite-range atomic basis sets for linear-scaling calculations E Anglada, JM Soler, J Junquera, E Artacho Physical Review B 66 (20), 205101, 2002 | 325 | 2002 |
| Stiff monatomic gold wires with a spinning zigzag geometry D Sánchez-Portal, E Artacho, J Junquera, P Ordejón, A García, JM Soler Physical review letters 83 (19), 3884, 1999 | 312 | 1999 |
| Observation of room-temperature polar skyrmions S Das, YL Tang, Z Hong, MAP Gonçalves, MR McCarter, C Klewe, ... Nature 568 (7752), 368-372, 2019 | 308 | 2019 |
| Spatially resolved steady-state negative capacitance AK Yadav, KX Nguyen, Z Hong, P García-Fernández, P Aguado-Puente, ... Nature 565 (7740), 468-471, 2019 | 202 | 2019 |
| Do thiols merely passivate gold nanoclusters? IL Garzón, C Rovira, K Michaelian, MR Beltrán, P Ordejón, J Junquera, ... Physical Review Letters 85 (24), 5250, 2000 | 176 | 2000 |
| First-principles calculation of the band offset at and interfaces J Junquera, M Zimmer, P Ordejón, P Ghosez Physical Review B 67 (15), 155327, 2003 | 163 | 2003 |
| Band alignment at metal/ferroelectric interfaces: Insights and artifacts from first principles M Stengel, P Aguado-Puente, NA Spaldin, J Junquera Physical Review B 83 (23), 235112, 2011 | 143 | 2011 |
| Finite-size effects in nanowires G Geneste, E Bousquet, J Junquera, P Ghosez Applied Physics Letters 88 (11), 112906, 2006 | 143 | 2006 |
| Phase coexistence and electric-field control of toroidal order in oxide superlattices AR Damodaran, JD Clarkson, Z Hong, H Liu, AK Yadav, CT Nelson, ... Nature materials 16 (10), 1003-1009, 2017 | 139 | 2017 |
| Ferromagneticlike closure domains in ferroelectric ultrathin films: first-principles simulations P Aguado-Puente, J Junquera Physical review letters 100 (17), 177601, 2008 | 136 | 2008 |
| Scaling of structure and electrical properties in ultrathin epitaxial ferroelectric heterostructures V Nagarajan, J Junquera, JQ He, CL Jia, R Waser, K Lee, YK Kim, S Baik, ... Journal of applied physics 100 (5), 051609, 2006 | 134 | 2006 |
| Siesta: Recent developments and applications A Garcia, N Papior, A Akhtar, E Artacho, V Blum, E Bosoni, P Brandimarte, ... The Journal of chemical physics 152 (20), 204108, 2020 | 127 | 2020 |
| Electrostatic coupling and local structural distortions at interfaces in ferroelectric/paraelectric superlattices P Zubko, N Jecklin, A Torres-Pardo, P Aguado-Puente, A Gloter, ... Nano letters 12 (6), 2846-2851, 2012 | 124 | 2012 |
| Systematic ab initio study of the electronic and magnetic properties of different pure and mixed iron systems J Izquierdo, A Vega, LC Balbás, D Sánchez-Portal, J Junquera, E Artacho, ... Physical Review B 61 (20), 13639, 2000 | 121 | 2000 |
| Atomically precise interfaces from non-stoichiometric deposition YF Nie, Y Zhu, CH Lee, LF Kourkoutis, JA Mundy, J Junquera, P Ghosez, ... Nature communications 5 (1), 1-8, 2014 | 104 | 2014 |
