First-principles determination of multicomponent hydride phase diagrams: application to the Li-Mg-NH system AR Akbarzadeh, V Ozolins, C Wolverton Advanced Materials (Weinheim) 19, 2007 | 266 | 2007 |
Finite-Temperature Properties of Relaxors from First Principles AR Akbarzadeh, S Prosandeev, EJ Walter, A Al-Barakaty, L Bellaiche Physical review letters 108 (25), 257601, 2012 | 189 | 2012 |
Combined theoretical and experimental study of the low-temperature properties of AR Akbarzadeh, I Kornev, C Malibert, L Bellaiche, JM Kiat Physical Review B—Condensed Matter and Materials Physics 72 (20), 205104, 2005 | 170 | 2005 |
Discovery of novel hydrogen storage materials: an atomic scale computational approach C Wolverton, DJ Siegel, AR Akbarzadeh, V Ozoliņš Journal of Physics: Condensed Matter 20 (6), 064228, 2008 | 135 | 2008 |
Field-induced percolation of polar nanoregions in relaxor ferroelectrics S Prosandeev, D Wang, AR Akbarzadeh, B Dkhil, L Bellaiche Physical review letters 110 (20), 207601, 2013 | 115 | 2013 |
Microscopic origins of the large piezoelectricity of leadfree (Ba,Ca)(Zr,Ti)O3 Y Nahas, A Akbarzadeh, S Prokhorenko, S Prosandeev, R Walter, ... Nature communications 8, 15944, 2017 | 101 | 2017 |
Atomistic simulations of the incipient ferroelectric AR Akbarzadeh, L Bellaiche, K Leung, J Íńiguez, D Vanderbilt Physical Review B—Condensed Matter and Materials Physics 70 (5), 054103, 2004 | 77 | 2004 |
First-principles determination of crystal structures, phase stability, and reaction thermodynamics in the Li-Mg-Al-H hydrogen storage system AR Akbarzadeh, C Wolverton, V Ozolins Physical Review B—Condensed Matter and Materials Physics 79 (18), 184102, 2009 | 73 | 2009 |
First-Principles Study of the Li− Mg− N− H System: Compound Structures and Hydrogen-Storage Properties KJ Michel, AR Akbarzadeh, V Ozolins The Journal of Physical Chemistry C 113 (32), 14551-14558, 2009 | 37 | 2009 |
First-principles computational discovery of materials for hydrogen storage V Ozolins, AR Akbarzadeh, H Gunaydin, K Michel, C Wolverton, ... Journal of Physics: Conference Series 180 (1), 012076, 2009 | 26 | 2009 |
Theoretical phase diagram of ultrathin films of incipient ferroelectrics AR Akbarzadeh, L Bellaiche, J Ińiguez, D Vanderbilt Applied physics letters 90 (24), 2007 | 26 | 2007 |
First-principles-based effective Hamiltonian simulations of bulks and films made of lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics S Prosandeev, D Wang, AR Akbarzadeh, L Bellaiche Journal of Physics.: Condensed Matter 27, 223202, 2015 | 23 | 2015 |
Crucial role of surface in stability and mobility of vacancy clusters in metals AR Akbarzadeh, ZZ Chen, N Kioussis Physical Review B—Condensed Matter and Materials Physics 79 (19), 195404, 2009 | 19 | 2009 |
Quantum-fluctuation-stabilized orthorhombic ferroelectric ground state in lead-free piezoelectric (Ba, Ca)(Zr, Ti) O A Akbarzadeh, K Brajesh, Y Nahas, N Kumar, S Prokhorenko, D Swain, ... Physical Review B 98, 104101, 2018 | 18 | 2018 |
First-principles prediction of high-capacity, thermodynamically reversible hydrogen storage reactions based on (NH)BH WQ Sun, C Wolverton, AR Akbarzadeh, V Ozolins Physical Review B—Condensed Matter and Materials Physics 83 (6), 064112, 2011 | 17 | 2011 |
Discovery of incipient ferrotoroidics from atomistic simulations S Prosandeev, AR Akbarzadeh, L Bellaiche Physical review letters 102 (25), 257601, 2009 | 17 | 2009 |
Terahertz pulse induced second harmonic generation and Kerr effect in the quantum paraelectric X Li, P Peng, H Dammak, G Geneste, A Akbarzadeh, S Prosandeev, ... Physical Review B 107 (6), 064306, 2023 | 6 | 2023 |
Metalloboranes from first-principles calculations: A candidate for high-density hydrogen storage AR Akbarzadeh, D Vrinceanu, CJ Tymczak arXiv preprint arXiv:1512.02128, 2015 | 1 | 2015 |
Erratum: First-principles prediction of high-capacity, thermodynamically reversible hydrogen storage reactions based on (NH)BH [Phys. Rev. B 83, 064112 … WQ Sun, C Wolverton, AR Akbarzadeh, V Ozolins Physical Review B—Condensed Matter and Materials Physics 84 (9), 099902, 2011 | 1 | 2011 |
High density H2 associative absorption on Titanium alpha-borozene (Ti2B6H6): An ab-initio case study A Akbarzadeh, CJ Tymzcak APS March Meeting Abstracts 2011, K1. 081, 2011 | 1 | 2011 |