| Topological phases in polar oxide nanostructures | REVIEWS OF MODERN PHYSICS | 2023 |
| Spherical ferroelectric solitons | NATURE MATERIALS | 2023 |
| Size-Induced Ferroelectricity in Antiferroelectric Oxide Membranes | ADVANCED MATERIALS | 2023 |
| Ferroelectric phase transitions in epitaxial antiferroelectric PbZrO3 thin films | APPLIED PHYSICS REVIEWS | 2023 |
| Photoinduced control of ferroelectricity in hybrid-improper ferroelectric superlattices | PHYSICAL REVIEW B | 2023 |
| Electrical topological defects induced by terahertz laser pulses | PHYSICAL REVIEW B | 2023 |
| Light: A new handle to control the structure of cesium lead iodide | PHYSICAL REVIEW B | 2023 |
| Stability of ferroelectric bubble domains | PHYSICAL REVIEW MATERIALS | 2023 |
| Generation of magnetic skyrmions in two-dimensional magnets via interfacial proximity | PHYSICAL REVIEW B | 2023 |
| Temperature-dependent properties of the antiferroelectric model PbZrO3: An effective Hamiltonian study | PHYSICAL REVIEW B | 2023 |
| Microscopic origin of the electric Dzyaloshinskii-Moriya interaction | PHYSICAL REVIEW B | 2023 |
| Bridging the gap between the short-range to long-range structural descriptions of the lead magnesium niobate relaxor | ACTA MATERIALIA | 2023 |
| Ferroelectric solitons crafted in epitaxial bismuth ferrite superlattices | NATURE COMMUNICATIONS | 2023 |
| Hexagonal Close-Packed Polar-Skyrmion Lattice in Ultrathin Ferroelectric PbTiO3 Films | PHYSICAL REVIEW LETTERS | 2023 |
| The anti-symmetric and anisotropic symmetric exchange interactions between electric dipoles in hafnia | Nature Communications | 2023 |
| Multiferroicity in Ga-substituted LuFeO3: A first-principles study | Physical Review Materials | 2023 |
| Toward Ultimate Memory with Single-Molecule Multiferroics | Journal of the American Chemical Society | 2023 |
| Electric-field-induced formation and annihilation of skyrmions in a two-dimensional magnet | Physical Review B | 2023 |
| Zeeman spin splittings with persistent spin textures in antiferromagnetic semiconductors | Physical Review B | 2023 |
| Flexoelectricity-stabilized ferroelectric phase with enhanced reliability in ultrathin La:HfO2 films | | 2023 |
| Flexoelectricity-stabilized ferroelectric phase with enhanced reliability in ultrathin La:HfO2 films | Applied Physics Reviews | 2023 |
| High-density switchable skyrmion-like polar nanodomains integrated on silicon | Nature | 2022 |
| Assembling Diverse Skyrmionic Phases in Fe3GeTe2 Monolayers | Advanced Materials | 2022 |
| Magnetically controllable band splittings in Pnma ferromagnetic materials | Physical Review B | 2022 |
| Ultrahigh energy storage density in lead-free antiferroelectric rare-earth-substituted bismuth ferrite | Physical Review Materials | 2022 |
| Deterministic control of ferroelectric polarization by ultrafast laser pulses | Nature Communications | 2022 |
| Hidden phases with neuromorphic responses and highly enhanced piezoelectricity in an antiferroelectric prototype | Physical Review B | 2022 |
| Domain-wall-induced electromagnons in multiferroics | Physical Review Materials | 2022 |
| Controlling the properties of PbTiO3/SrTiO(3 )superlattices by photoexcited carriers | PHYSICAL REVIEW B | 2022 |
| THz-induced activation of hidden states in rare-earth-doped BiFeO3 solid solutions | PHYSICAL REVIEW MATERIALS | 2022 |
| Zeeman Effect in Centrosymmetric Antiferromagnetic Semiconductors Controlled by an Electric Field | PHYSICAL REVIEW LETTERS | 2022 |
| Anomalous ferroelectricity and double-negative effects in bilayer hexagonal boron nitride | PHYSICAL REVIEW B | 2022 |
| Strain-induced ferroelectricity and piezoelectricity in centrosymmetric binary oxides | PHYSICAL REVIEW B | 2022 |
| Ultrafast Activation and Tuning of Topological Textures in Ferroelectric Nanostructures | ADVANCED ELECTRONIC MATERIALS | 2022 |
| Ferroelectricity in Charge-Ordering Crystals with Centrosymmetric Lattices | CHINESE PHYSICS LETTERS | 2022 |
| Two-Dimensional Organic-Inorganic Room-Temperature Multiferroics | JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 2022 |
| Energy storage in lead-free Ba(Zr, Ti)O-3 relaxor ferroelectrics: Large densities and efficiencies and their origins | Physical Review B | 2022 |
| Zeeman-type energy level splittings controlled by an electric field | Physical Review B | 2022 |
| Controlling topological defect transitions in nanoscale lead zirconate titanate heterostructures | PHYSICAL REVIEW MATERIALS | 2021 |
| Magnetoelastic standing waves induced in UO2 by microsecond magnetic field pulses | Proceedings of the National Academy of Sciences of the United States of America | 2021 |
| Effect of the polar distortion on the thermoelectric properties of GeTe | EUROPEAN PHYSICAL JOURNAL B | 2021 |
| Ultrafast Neuromorphic Dynamics Using Hidden Phases in the Prototype of Relaxor Ferroelectrics | PHYSICAL REVIEW LETTERS | 2021 |
| Properties of (001) NaNbO3 films under epitaxial strain: A first-principles study | PHYSICAL REVIEW B | 2021 |
| Electrocaloric effects in multiferroics | PHYSICAL REVIEW B | 2021 |
| Coexistence and Coupling of Multiple Charge Orderings and Spin States in Hexagonal Ferrite | Nano Letters | 2021 |
| Spin-polarized electronic states and atomic reconstructions at antiperovskite Sr3SnO(001) polar surfaces | Physical Review B | 2021 |
| Ultrahigh energy storage density in epitaxial AlN/ScN superlattices | Physical Review Materials | 2021 |
| First-principles study of spin spirals in the multiferroic BiFeO3 | Physical Review B | 2021 |
| Ferroelectric phase-transition frustration near a tricritical composition point | NATURE COMMUNICATIONS | 2021 |
| Ferroelectric phase-transition frustration near a tricritical composition point | NATURE COMMUNICATIONS | 2021 |
| Finite-Temperature Dynamics in Cesium Lead Iodide Halide Perovskite | ADVANCED FUNCTIONAL MATERIALS | 2021 |
| Spin-orbit effects in ferroelectric PbTiO3 under tensile strain | PHYSICAL REVIEW B | 2021 |
| Structural and magnetic properties of two-dimensional layered BiFeO3 from first principles | PHYSICAL REVIEW B | 2021 |
| Revisiting structural phases in some perovskites: The case of BaCeO3 | PHYSICAL REVIEW B | 2021 |
| Energetic Couplings in Ferroics | ADVANCED ELECTRONIC MATERIALS | 2021 |
| Anisotropic epitaxial stabilization of a low-symmetry ferroelectric with enhanced electromechanical response | NATURE MATERIALS | 2021 |
| Freestanding Ferroelectric Bubble Domains | Advanced Materials | 2021 |
| Strain-induced resonances in the dynamical quadratic magnetoelectric response of multiferroics | NPJ COMPUTATIONAL MATERIALS | 2020 |
| Designing frustration in two-dimensional magnetic systems via the application of uniaxial strain | PHYSICAL REVIEW B | 2020 |
| Dzyaloshinskii-Moriya-like interaction in ferroelectrics and antiferroelectrics | NATURE MATERIALS | 2020 |
| Enhanced transient negative capacitance during inhomogeneous ferroelectric switching | PHYSICAL REVIEW B | 2020 |
| Universality and origin of ultrashort intrinsic negative dielectric permittivity | PHYSICAL REVIEW B | 2020 |
| Topology and control of self-assembled domain patterns in low-dimensional ferroelectrics | NATURE COMMUNICATIONS | 2020 |
| Possible Kitaev Quantum Spin Liquid State in 2D Materials with S=3/2 | PHYSICAL REVIEW LETTERS | 2020 |
| Topological spin texture in Janus monolayers of the chromium trihalides Cr(I, X)(3) | PHYSICAL REVIEW B | 2020 |
| Inverse transition of labyrinthine domain patterns in ferroelectric thin films | NATURE | 2020 |
| Band structure engineering of van der Waals heterostructures using ferroelectric clamped sandwich structures | PHYSICAL REVIEW B | 2020 |
| Atomic-scale origin of ultrahigh piezoelectricity in samarium-doped PMN-PT ceramics | PHYSICAL REVIEW B | 2020 |
| Strain-induced resonances in the dynamical quadratic magnetoelectric response of multiferroics | NPJ COMPUTATIONAL MATERIALS | 2020 |
| Macroscopic and Microscopic Structures of Cesium Lead Iodide Perovskite from Atomistic Simulations | ADVANCED FUNCTIONAL MATERIALS | 2020 |
| Improper ferroelectricity in 134-type AA ' 3B4O12 perovskites | PHYSICAL REVIEW B | 2020 |
| Design of broad and large physical responses from atomistic simulations | PHYSICAL REVIEW B | 2020 |
| Evidence for Goldstone-like and Higgs-like structural modes in the model PbMg1/3Nb2/3O3 relaxor ferroelectric | PHYSICAL REVIEW B | 2020 |
| Purely Cubic Spin Splittings with Persistent Spin Textures | PHYSICAL REVIEW LETTERS | 2020 |
| Emergence of skyrmionium in a two-dimensional CrGe(Se,Te)(3) Janus monolayer | PHYSICAL REVIEW B | 2020 |
| Strain control of layer-resolved negative capacitance in superlattices | NPJ COMPUTATIONAL MATERIALS | 2020 |
| Uncompensated Polarization in Incommensurate Modulations of Perovskite Antiferroelectrics | PHYSICAL REVIEW LETTERS | 2019 |
| Prediction of room-temperature half-metallicity in layered halide double perovskites | NPJ COMPUTATIONAL MATERIALS | 2019 |
| Conformational Domain Wall Switch | Advanced Functional Materials | 2019 |
| Giant piezoelectricity of Sm-doped Pb(Mg1/3Nb2/3)O-3-PbTiO3 single crystals | Science | 2019 |
| Expansion of the spin cycloid in multiferroic BiFeO3 thin films | NPJ Quantum Materials | 2019 |
| First-principles screening of ABO(3) oxides with two magnetic sublattices | Physical Review Materials | 2019 |
| Ferroelectricity with Asymmetric Hysteresis in Metallic LiOsO3 Ultrathin Films | Physical Review Letters | 2019 |
| Magnetoelastic and magnetoelectric couplings across the antiferromagnetic transition in multiferroic BiFeO3, | Physical Review B | 2019 |
| Photovoltaics in Ferroelectric Materials: Origin, Challenges and Opportunities | Advanced Materials Book Series | 2019 |
| Photoinduced Phase Transitions in Ferroelectrics | Physical Review Letters | 2019 |
| A-site Partially Ordered La0.5Y0.5FeO3 and its Multiferroic Characteristics | Applied Physics Letters | 2019 |
| Order-disorder transition in the prototypical antiferroelectric PbZrO3 | Physical Review B | 2019 |
| Electric-Field Control of Magnetization, Jahn-Teller Distortion, and Orbital Ordering in Ferroelectric Ferromagnets | Physical Review Letters | 2019 |
| Designing Multifunctionality via Assembling Dissimilar Materials: Epitaxial AlN/ScN Superlattices | Physical Review Letters | 2019 |
| Symmetry modulation and enhanced multiferroic characteristics in Bi1-xNdxFeO3 ceramics | Advanced Functional Materials | 2019 |
| Deterministic switching of ferroelectric bubble nanodomains | Advanced Functional Materials | 2019 |
| Magnetic Interactions in BiFeO3: a First-Principles Study | Physical Review B | 2019 |
| Strain engineering of electro-optic constants in ferroelectric materials | NPJ Computational Materials | 2019 |
| Prediction of a novel topological multidefect ground state | PHYSICAL REVIEW B | 2019 |
| Temperature dependence of polar modes in hybrid improper ferroelectrics | PHYSICAL REVIEW B | 2019 |
| Novel Dynamical Magnetoelectric Effects in Multiferroic BiFeO3 | Physical Review Letters | 2019 |
| Strain engineering of electro-optic constants in ferroelectric materials (vol 5, 6, 2019) | NPJ Computational Materials | 2019 |
| Giant resistive switching in mixed phase BiFeO3 via phase population control | NANOSCALE | 2018 |
| Displacement Current in Domain Walls of Bismuth Ferrite | NPJ COMPUTATIONAL MATERIALS | 2018 |
| Giant electrocaloric response in the prototypical Pb(Mg,Nb)O-3 relaxor ferroelectric from atomistic simulations | PHYSICAL REVIEW B | 2018 |
| Temperature and electric field control of the bandgap in electrotoroidic nanocomposites by large-scale ab initio methods | FERROELECTRICS | 2018 |
| Flexible polarization rotation at the ferroelectric/metal interface as a seed for domain nucleation | PHYSICAL REVIEW B | 2018 |
| Tailoring properties of hybrid perovskites by domain-width engineering with charged walls | NPJ Computational Materials | 2018 |
| Flexible polarization rotation at the ferroelectric/metal interface as a seed for domain nucleation | Physical Review B | 2018 |
| Polarization switching in the PbMg1/3Nb2/3O3 relaxor ferroelectric: An atomistic effective Hamiltonian study | Physical Review B | 2018 |
| Revisiting spin cycloids in multiferroic BiFeO3 | PHYSICAL REVIEW B | 2018 |
| Giant resistive switching in mixed phase BiFeO(3)via phase population control (vol 10, pg 17629, 2018) | NANOSCALE | 2018 |
| Interplay between Kitaev interaction and single ion anisotropy in ferromagnetic CrI3 and CrGeTe3 monolayers | NPJ COMPUTATIONAL MATERIALS | 2018 |
| Structural and magnetic transitions accompanied by large responses in epitaxial Sr0.5Ba0.5MnO3 films | PHYSICAL REVIEW MATERIALS | 2018 |
| Novel type of ferroelectricity in brownmillerite structures: A first-principles study | PHYSICAL REVIEW MATERIALS | 2018 |
| Polarization switching in the PbMg1/3Nb2/3O3 relaxor ferroelectric: An atomistic effective Hamiltonian study | PHYSICAL REVIEW B | 2018 |
| Large scale Hybrid Monte Carlo simulations for structure and property prediction | NPJ Computational Materials | 2018 |
| Quantum-fluctuation-stabilized orthorhombic ferroelectric ground state in lead-free piezoelectric (Ba, Ca)(Zr, Ti)O-3 | PHYSICAL REVIEW B | 2018 |
| Energetics of oxygen-octahedra rotations in perovskite oxides from first principles | Physical Review B | 2018 |
| Photostriction and elasto-optic response in multiferroics and ferroelectrics from first principles | Journal of Physics: Condensed Matter | 2018 |
| Structural phases arising from reconstructive and isostructural transitions in high-melting-point oxides under hydrostatic pressure: a first-principles study | Physical Review B Rapid Communications | 2018 |
| Interface reconstruction with emerging charge ordering in hexagonal manganite | Science Advances | 2018 |
| Topological Defects with Distinct Dipole Configurations in PbTiO3/SrTiO3 Multilayer Films | Physical Review Letters | 2018 |
| Understanding and revisiting the most complex perovskite system via atomistic simulations | Physical Review B | 2018 |
| Intrinsic Origin of Enhancement of Ferroelectricity in SnTe Ultrathin Films | PHYSICAL REVIEW LETTERS | 2018 |
| Designing switchable near room-temperature multiferroics via the discovery of a novel magnetoelectric coupling | New Journal of Physics | 2018 |
| Pinched Hysteresis Loop in Defect-Free Materials | Physical Review B | 2017 (In Press) |
| Vacancies and holes in bulk and at 180 degrees domain walls in lead titanate | Journal of Physics - Condensed Matter | 2017 |
| Novel multiferroic phases and phenomena in epitaxial (111) BiFeO3 films | Advanced Electronic Materials | 2017 |
| Nanoscale Bubble Domains and Topological Transitions in Ultrathin Ferroelectric Films | Advanced Materials | 2017 |
| Improper ferroelectricity at antiferromagnetic domain walls of perovskite oxides | Physical Review B | 2017 |
| Creating a low-symmetry insulating, ferroelectric, and antiferromagnetic material from a high-symmetrical metallic ferromagnet via defect engineering: The case of LaBaCo2O5+delta compounds | Physical Review B | 2017 |
| Intrinsic polarization switching mechanisms in BiFeO3 | Physical Review B | 2017 |
| Fluctuations and Topological Defects in Proper Ferroelectric Crystals | Physical Review Letters | 2017 |
| Properties of rare-earth iron garnets from first principles | Physical Review B | 2017 |
| Improper electric polarization in simple perovskite oxides with two magnetic sublattices | Nature Communications | 2017 |
| Dependence of the Electronic and Optical Properties of Methylammonium Lead Triiodide on Ferroelectric Polarization Directions and Domains: A First Principles Computational Study | Journal of Physical Chemistry C | 2017 |
| Microscopic origins of the large piezoelectricity of leadfree (Ba,Ca)(Zr,Ti)O3 | Nature Communications | 2017 |
| Dynamics of antipolar distortions | npj Computational Materials | 2017 |
| Emergent Berezinskii-Kosterlitz-Thouless phase in low-dimensional ferroelectrics | Physical Review Letters | 2017 |
| Rules and mechanisms governing octahedral tilts in perovskites under pressure | Physical Review B | 2017 |
| Ab-initio approach to photostriction in classical ferroelectric material | Physical Review B | 2017 |
| Electrocaloric effects in the lead-free Ba(Zr,Ti)O$_{3}$ relaxor ferroelectric from atomistic simulations | Physical Review B | 2017 |
| Learning through ferroelectric domain dynamics in solid-state synapses | Nature Communications | 2017 |
| Toy model for uncommon spin-orbit-driven spin-torque terms | Journal of Physics - Condensed Matter | 2017 |
| Pressure-induced multiferroics via pseudo Jahn-Teller effects and novel couplings | Advanced Functional Materials | 2017 |
| Designing lead-free antiferroelectrics for energy storage | Nature Communications | 2017 |
| Ab initio approach to photostriction in classical ferroelectric materials | PHYSICAL REVIEW B | 2017 |
| Electrocaloric effects in the lead- free Ba(Zr, Ti)O-3 relaxor ferroelectric from atomistic simulations | PHYSICAL REVIEW B | 2017 |
| Microscopic origins of the large piezoelectricity of leadfree (Ba,Ca)(Zr,Ti)O-3 | NATURE COMMUNICATIONS | 2017 |
| Ferroelectric Vortices and Related Configurations | Invited Review in Nanoscale Ferroelectrics and Multiferroics: Key Processing and Characterization Issues, and Nanoscale Effects | 2016 |
| New relativistic Hamiltonian: the Angular MagnetoElectric coupling | Proc. SPIE Spintronics IX | 2016 |
| Special quasirandom structures for perovskite solid solutions | Journal of Physics: Condensed Matter | 2016 |
| Atomistic mechanism leading to complex antiferroelectric and incommensurate perovskites | Physical Review B | 2016 |
| Electrical Control of Chiral Phases in Electrotoroidic Nanocomposites | Advanced Electronic Materials | 2016 |
| Towards multicaloric effect with ferroelectrics | Physical Review B | 2016 |
| Chemical strain-dependent two-dimensional transport at RAlO3/SrTiO3 interfaces (R = La, Nd, Sm, and Gd) | Physical Review B | 2016 |
| Simulating the Radio-Frequency Dielectric Response of Relaxor Ferroelectrics: Combination of Coarse-Grained Hamiltonians and Kinetic Monte Carlo Simulations | Physical Review Letters | 2016 |
| Photostriction in Ferroelectrics from Density Functional Theory | Physical Review Letters | 2016 |
| Wang-Landau Monte Carlo formalism applied to ferroelectrics | Physical Review B | 2016 |
| Room-temperature paramagnetoelectric effect in magnetoelectric multiferroics Pb(Fe1/2Nb1/2)O-3 and its solid solution with PbTiO3 | Journal of Materials Science | 2016 |
| A multiferroic on the brink: Uncovering the nuances of strain-induced transitions in BiFeO3 | Applied Physics Reviews | 2016 |
| Large elasto-optic effect and reversible electrochromism in multiferroic BiFeO3 | Nature Communications | 2016 |
| Frustration and Self-Ordering of Topological Defects in Ferroelectrics | Physical Review Letters | 2016 |
| Topological Point Defects in Relaxor Ferroelectrics | Physical Review Letters | 2016 |
| Subterahertz dielectric relaxation in lead-free Ba(Zr,Ti)O-3 relaxor ferroelectrics | Nature Communications | 2016 |
| Origin of the magnetization and compensation temperature in rare-earth orthoferrites and orthochromates | Physical Review B | 2016 |
| Structural Phase Transition and Material Properties of Few-Layer Monochalcogenides | Physical Review Letters | 2016 |
| Systematic pseudopotentials from reference eigenvalue sets for DFT calculations | Computational Materials Science | 2015 |
| Prediction of a stable post-post-perovskite structure from first principles | Physical Review B | 2015 |
| Tuning and optimizing properties of ferroelectric films grown on a single substrate: a first-principles-based study | Physical Review B | 2015 |
| Electronic properties of electrical vortices in ferroelectric nanocomposites from large-scale ab-initio computations | Nano Letters | 2015 |
| Hybrid Improper Ferroelectricity in Multiferroic Superlattices: Finite-Temperature Properties and Electric-Field-Driven Switching of Polarization and Magnetization | Advanced Functional Materials | 2015 |
| Giant Negative Electrocaloric Effect in Antiferroelectric La-Doped Pb(ZrTi)O3 Thin Films Near Room Temperature | Advanced Materials | 2015 |
| First-principles-based effective Hamiltonian simulations of bulks and films made of lead-free Ba(Zr,Ti)O3 relaxor ferroelectrics | Journal of Physics: Condensed Matter | 2015 |
| Magnetoelectric effects via pentalinear interactions | Physical Review B | 2015 |
| Influence of epitaxial strain on elastocaloric effect in ferroelectric thin films | Applied Physics Letters | 2015 |
| Exploiting interfacial and size effects to construct oxide superlattices with robust and tunable magnetoelectric properties at room temperature | Physical Review B | 2015 |
| Dynamical magnetoelectric effects associated with ferroelectric domain walls | Physical Review B | 2015 |
| Strain effects on multiferroic BiFeO3 films | Comptes Rendus Physique | 2015 |
| Predicting a Ferrimagnetic phase of Zn2FeOsO6 with Strong Magnetoelectric Coupling | Physical Review Letters | 2015 |
| Discovery of stable skyrmionic state in ferroelectric nanocomposites | Nature Communications | 2015 |
| Relativistic interaction Hamiltonian coupling the angular momentum of light and the electron spin | Physical Review B | 2015 |
| Finite-temperature properties of the relaxor PbMg1/3Nb2/3O3 from atomistic simulations | Physical Review B | 2015 |
| Predicted energetics and properties of rare-earth ferrites films grown on cubic (111)- and hexagonal (0001)-oriented substrates | Journal of Physics: Condensed Matter | 2015 |
| Driving spin excitations by hydrostatic pressure in BiFeO3 | Physical Review Letters | 2015 |
| Large Elasto-Optic Effect in Epitaxial PbTiO3 Films | Physical Review Letters | 2015 |
| Predicted pressure-induced spin and electronic transition in double perovskite R2CoMnO 6 ( R = rare-earth ion) | Journal of Physics: Condensed Matter | 2015 |
| Nanodomains and nanometer-scale disorder in multiferroic bismuth ferrite single crystals | Acta Materialia | 2015 |
| Anomalous properties of hexagonal rare-earth ferrites from first principles | Physical Review B | 2014 |
| Properties of hydrofluorinated carbon- and boron nitride-based nanofilms: A first-principles study | Physical Review B | 2014 |
| Anomalous properties of antiferroelectric PbZrO3 under hydrostatic pressure | Physical Review B | 2014 |
| Strain engineering of perovskite thin films using a single substrate | Journal of physics. Condensed matter : an Institute of Physics journal | 2014 |
| Prediction of novel interface-driven spintronic effects | Journal of physics. Condensed matter : an Institute of Physics journal | 2014 |
| Fano resonance and dipolar relaxation in lead-free relaxors | Nature Communications | 2014 |
| Structural, magnetic, and electronic properties of GdTiO3 Mott insulator thin films grown by pulsed laser deposition | Applied Physics Letters | 2014 |
| Revisiting galvanomagnetic effects in conducting ferromagnets | Journal of Physics - Condensed Matter | 2014 |
| Effects of chemical and hydrostatic pressures on structural, magnetic, and electronic properties of R 2NiMnO 6(R=rare-earth ion) double perovskites | Physical Review B | 2014 |
| Creating multiferroics with large tunable electrical polarization from paraelectric rare-earth orthoferrites. | Journal of Physics - Condensed Matter | 2014 |
| Near room-temperature multiferroic materials with tunable ferromagnetic and electrical properties | Nature Communications | 2014 |
| Giant Room-Temperature Elastocaloric Effect in Ferroelectric Ultrathin Films | Advanced Materials | 2014 |
| Terahertz dynamics of ferroelectric vortices from first principles | Physical Review B | 2014 |
| Atomistic theory of hybrid improper ferroelectricity in perovskites | Physical Review B | 2014 |
| Ultrafast Switching of the Electric Polarization and Magnetic Chirality in BiFeO3 by an Electric Field | Physical Review Letters | 2014 |
| First-principles study of the multimode antiferroelectric transition in PbZrO3 | Physical Review B | 2014 |
| Control of ferroelectricity and magnetism in multi-ferroic BiFeO3 by epitaxial strain | Philosophical Transactions of the Royal Society A | 2014 |
| Quantum Anomalous Hall Effect in Graphene Proximity Coupled to an Antiferromagnetic Insulator | Physical Review Letters | 2014 |
| The stabilization of a single domain in free-standing ferroelectric nanocrystals | Journal of Physics - Condensed Matter | 2014 |
| Effects of a rotating electric field on the properties of epitaxial (001) Pb(Zr, Ti)O-3 ultrathin film: a first-principles-based study | Journal of Physics - Condensed Matter | 2014 |
| Strain-induced control of domain wall morphology in ultrathin PbTiO 3 films | Physical Review B | 2014 |
| Finite-Temperature Properties of Rare-Earth-Substituted BiFeO3 Multiferroic Solid Solutions | Advanced Functional Materials | 2014 |
| Prediction of a Novel Magnetoelectric Switching Mechanism in Multiferroics | Physical Review Letters | 2014 |
| Magnetoelectric signature in the magnetic properties of antiferromagnetic multiferroics: Atomistic simulations and phenomenology | Physical Review B | 2013 |
| Universal collaborative couplings between oxygen-octahedral rotations and antiferroelectric distortions in perovskites | Physical Review B | 2013 |
| Terahertz Dielectric Response and Coupled Dynamics of Ferroelectrics and Multiferroics from Effective Hamiltonian Simulations | International Journal of Modern Physics B | 2013 |
| Effect of chemical pressure, misfit strain and hydrostatic pressure on structural and magnetic behaviors of rare-earth orthochromates | Journal of Physics: Condensed Matter | 2013 |
| Crafting the magnonic and spintronic response of BiFeO3 films by epitaxial strain | Nature Materials | 2013 |
| Properties of Epitaxial Films Made of Relaxor Ferroelectrics | Physical Review Letters | 2013 |
| Emergence of central mode in the paraelectric phase of ferroelectric perovskites | MRS Communications | 2013 |
| Effect of central mode on the dielectric tunability of ferroelectrics near room temperature: a first-principle-based study | Journal of Physics: Condensed Matter | 2013 |
| Novel Nanoscale Twinned Phases in Perovskite Oxides | Advanced Functional Materials | 2013 |
| Elastic excitations in BaTiO3 single crystals and ceramics: Mobile domain boundaries and polar nanoregions observed by resonant ultrasonic spectroscopy | Physical Review B | 2013 |
| Predicted Coupling of the Electromagnetic Angular Momentum Density with Magnetic Moments | Physical Review Letters | 2013 |
| Ferroelectric Domains in Multiferroic BiFeO3 Films under Epitaxial Strains | Physical Review Letters | 2013 |
| Field-Induced Percolation of Polar Nanoregions in Relaxor Ferroelectrics | Physical Review Letters | 2013 |
| Full field electron spectromicroscopy applied to ferroelectric materials | Journal of Applied Physics | 2013 |
| Natural optical activity and its control by electric field in electrotoroidic systems | Physical Review B | 2013 |
| Spin switching and magnetization reversal in single-crystal NdFeO3 | Physical Review B | 2013 |
| Multidomains made of different structural phases in multiferroic BiFeO3: A first-principles-based study | Physical Review B | 2013 |
| Effect of Chemical and Hydrostatic Pressures on Structural and Magnetic Properties of Rare-earth Orthoferrites: a First-principles Study | Journal of Physics: Condensed Matter | 2013 |
| Coupling of the angular momentum density with magnetic moments explains the intrinsic anomalous Hall effect | Physical Review B | 2013 |
| Strain dependence of polarization and piezoelectric response in epitaxial BiFeO3 thin films | Journal of Physics-Condensed Matter | 2012 |
| Low-frequency coupled modes in disordered Pb(Zr,Ti)O-3 solid solutions from first principles | Physical Review B | 2012 |
| Revisiting Properties of Ferroelectric and Multiferroic Thin Films under Tensile Strain from First Principles | Physical Review Letters | 2012 |
| Study of strain effect on in-plane polarization in epitaxial BiFeO 3 thin films using planar electrodes | Physical Review B | 2012 |
| Epitaxial short-period PbTiO 3/BiFeO 3 superlattices studied by first-principles calculations | Physical Review B | 2012 |
| Understanding and Revisiting Properties of EuTiO3 Bulk Material and Films from First Principles | Physical Review Letters | 2012 |
| Study of strain effect on in-plane polarization in epitaxial BiFeO3 thin films using planar electrodes | Physical Review B | 2012 |
| Electronic transition from graphite to graphene via controlled movement of the top layer with scanning tunneling microscopy | Physical Review B | 2012 |
| Atomistic Molecular Dynamic Simulations of Multiferroics | Physical Review Letters | 2012 |
| Domain evolution in epitaxial (001) Pb(Zr,Ti)O-3 ultrathin films under an electric field applied along the [111] direction | Physical Review B | 2012 |
| Magnetic Cycloid of BiFeO3 from Atomistic Simulations | Physical Review Letters | 2012 |
| Novel complex phenomena in ferroelectric nanocomposites | Journal of Physics-Condensed Matter | 2012 |
| A simple law governing coupled magnetic orders in perovskites | Journal of Physics-Condensed Matter | 2012 |
| Thickness-Dependent Polarization of Strained BiFeO3 Films with Constant Tetragonality | Physical Review Letters | 2012 |
| Atomic control of strain in freestanding graphene | Physical Review B | 2012 |
| A pathway between Bernal and rhombohedral stacked graphene layers with scanning tunneling microscopy | Applied Physics Letters | 2012 |
| Ab initio study of the factors affecting the ground state of rare-earth nickelates | Physical Review B | 2012 |
| New scanning tunneling microscopy technique enables systematic study of the unique electronic transition from graphite to graphene | Carbon | 2012 |
| Enhanced electric conductivity at ferroelectric vortex cores in BiFeO3 | Nature Physics | 2012 |
| Giant direct magnetoelectric effect in strained multiferroic heterostructures | Physical Review B | 2012 |
| Finite-temperature flexoelectricity in ferroelectric thin films from first principles | Physical Review B | 2012 |
| Finite-Temperature Properties of Ba(Zr, Ti)O-3 Relaxors from First Principles | Physical Review Letters | 2012 |
| Magnetoelectricity in BiFeO3 films: First-principles-based computations and phenomenology | Physical Review B | 2011 |
| Fermi Resonance Involving Nonlinear Dynamical Couplings in Pb(Zr, Ti)O-3 Solid Solutions | Physical Review Letters | 2011 |
| Multiferroic Phase Transition near Room Temperature in BiFeO3 Films | Physical Review Letters | 2011 |
| Geometric frustration in compositionally modulated ferroelectrics | Nature | 2011 |
| Coexistence of ferroelectric triclinic phases in highly strained BiFeO3 films | Physical Review B | 2011 |
| Epitaxial Pb(Zr, Ti)O-3 Ultrathin Films under Open-Circuit Electrical Boundary Conditions | Physical Review Letters | 2011 |
| Dynamical coupling in Pb(Zr,Ti)O-3 solid solutions from first principles | Physical Review B | 2011 |
| Phase Transitions in Epitaxial (-110) BiFeO3 Films from First Principles | Physical Review Letters | 2011 |
| BiFeO3 Films under Tensile Epitaxial Strain from First Principles | Physical Review Letters | 2011 |
| Giant surface charge density of graphene resolved from scanning tunneling microscopy and first-principles theory | Physical Review B | 2011 |
| Domain structure and in-plane switching in a highly strained Bi0.9Sm0.1FeO3 film | Applied Physics Letters | 2011 |
| Shape-induced phase transition of domain patterns in ferroelectric platelets | Physical Review B | 2011 |
| Properties of epitaxial (110) BaTiO3 films from first principles | Physical Review B | 2011 |
| Prediction of the Magnetotoroidic Effect from Atomistic Simulations | Physical Review Letters | 2011 |
| Size effects in multiferroic BiFeO3 nanodots: A first-principles-based study | Physical Review B | 2010 |
| Diffuse phase transitions in ferroelectric ultrathin films from first principles | Physical Review B | 2010 |
| Dependence of Curie temperature on the thickness of an ultrathin ferroelectric film | Physical Review B | 2010 |
| Competing phases in BiFeO3 thin films under compressive epitaxial strain | Physical Review B | 2010 |
| Chiral Patterns of Tilting of Oxygen Octahedra in Zero-Dimensional Ferroelectrics and Multiferroics: A First Principle-Based Study | Physical Review Letters | 2010 |
| Bridging Multiferroic Phase Transitions by Epitaxial Strain in BiFeO3 | Physical Review Letters | 2010 |
| Ferromagnetism in multiferroic BiFeO3 films: A first-principles-based study | Physical Review B | 2010 |
| Lattice dynamics in Ba0.7Sr0.3TiO3: study by THz and IR spectroscopy and ab initio simulations | Phase Transitions | 2010 |
| Low-Symmetry Phases in Ferroelectric Nanowires | Nano Letters | 2010 |
| Low-symmetry phases and loss of relaxation in nanosized lead scandium niobate | Physical Review B | 2010 |
| Kittel Law in BiFeO3 Ultrathin Films: A First-Principles-Based Study | Physical Review Letters | 2010 |
| Intermediate temperature scale T-* in lead-based relaxor systems | Physical Review B | 2009 |
| Evidence for Room-Temperature Multiferroicity in a Compound with a Giant Axial Ratio | Physical Review Letters | 2009 |
| Hypertoroidal moment in complex dipolar structures | Journal of Materials Science | 2009 |
| Broad-band dielectric spectroscopy and ferroelectric soft-mode response in the Ba0.6Sr0.4TiO3 solid solution | Journal of Physics-Condensed Matter | 2009 |
| Electric Field Induced by Dynamical Change of Dipolar Configurations in Ferromagnets | Physical Review Letters | 2009 |
| Erratum: Properties of multiferroic BiFeO3 under high magnetic fields from first principles (vol 79, 012101, 2009) | Physical Review B | 2009 |
| Electric-Field-Induced Paths in Multiferroic BiFeO3 from Atomistic Simulations | Physical Review Letters | 2009 |
| Critical Behavior in Ferroelectrics from First Principles | Physical Review Letters | 2009 |
| Nature of the ferroelectric phase transition in multiferroic BiFeO3 from first principles | Physical Review B | 2009 |
| Phase diagrams of epitaxial Pb(Zr, Ti)O-3 ultrathin films from first principles | Physical Review B | 2009 |
| Properties of multiferroic BiFeO3 under high magnetic fields from first principles | Physical Review B | 2009 |
| Discovery of Incipient Ferrotoroidics from Atomistic Simulations | Physical Review Letters | 2009 |
| Unusual static and dynamical characteristics of domain evolution in ferroelectric superlattices | Physical Review B | 2009 |
| Terahertz dielectric response of cubic BaTiO(3) | Physical Review B | 2008 |
| Phase stability and structural temperature dependence in powdered multiferroic BiFeO(3) | Physical Review B | 2008 |
| Nature of Dynamical Coupling between Polarization and Strain in Nanoscale Ferroelectrics from First Principles | Physical Review Letters | 2008 |
| Original properties of dipole vortices in zero-dimensional ferroelectrics | Journal of Physics-Condensed Matter | 2008 |
| Order parameter in complex dipolar structures: Microscopic modeling | Physical Review B | 2008 |
| Dependence of polarization on epitaxial strain in ferroelectric ultrathin films from first principles | Physical Review B | 2008 |
| Controlling double vortex states in low-dimensional dipolar systems | Physical Review Letters | 2008 |
| Control of vortices by homogeneous fields in asymmetric ferroelectric and ferromagnetic rings | Physical Review Letters | 2008 |
| Coexistence of the Phonon and Relaxation Soft Modes in the Terahertz Dielectric Response of Tetragonal BaTiO(3) | Physical Review Letters | 2008 |
| Electrocaloric effect in bulk and low-dimensional ferroelectrics from first principles | Physical Review B | 2008 |
| Infrared and THz Soft-Mode Spectroscopy of (Ba,Sr)TiO3 Ceramics | Ferroelectrics | 2008 |
| High-Pressure Effect on PbTiO(3): An Investigation by Raman and X-Ray Scattering up to 63 GPa | Physical Review Letters | 2008 |
| Influence of crystallographic steps on properties of ferroelectric ultrathin films: An ab initio study | Applied Physics Letters | 2007 |
| Effects of vacancies on the properties of disordered ferroelectrics: A first-principles study | Physical Review B | 2007 |
| Characteristics and signatures of dipole vortices in ferroelectric nanodots: First-principles-based simulations and analytical expressions | Physical Review B | 2007 |
| Finite-temperature properties of multiferroic BiFeO(3) | Physical Review Letters | 2007 |
| Dielectric anomalies in ferroelectric nanostructures | Physical Review Letters | 2007 |
| Domain evolution of BaTiO3 ultrathin films under an electric field: A first-principles study | Physical Review B | 2007 |
| Phase diagrams of BaTiO3/SrTiO3 superlattices from first principles | Physical Review B | 2007 |
| Tensors in ferroelectric nanoparticles: First-principles-based simulations | Physical Review B | 2007 |
| The nature of ferroelectricity under pressure | Phase Transitions | 2007 |
| Thickness dependency of 180 degrees stripe domains in ferroelectric ultrathin films: A first-principles-based study | Applied Physics Letters | 2007 |
| Theoretical phase diagram of ultrathin films of incipient ferroelectrics | Applied Physics Letters | 2007 |
| Relation between dielectric responses and polarization fluctuations in ferroelectric nanostructures | Physical Review B | 2007 |
| Asymmetric screening of the depolarizing field in a ferroelectric thin film | Physical Review B | 2007 |
| Polar and chemical order in relation with morphotropic phase boundaries and relaxor behaviour in bulk and nanostructured PSN-PT | Phase Transitions | 2006 |
| Properties of ferroelectric nanodots embedded in a polarizable medium: Atomistic simulations | Physical Review Letters | 2006 |
| Properties of ferroelectric ultrathin films from first principles | Journal of Materials Science | 2006 |
| Symmetry breaking at the nanoscale and diffuse transitions in ferroelectrics: A comparative study of PbSc(1/2)Nb(1/2)O(3) and PbZr(0.6)Ti(0.4)O(3) | Physical Review B | 2006 |
| Phase diagram of Pb(Zr,Ti)O-3 solid solutions from first principles | Physical Review Letters | 2006 |
| Electric-field-induced domain evolution in ferroelectric ultrathin films | Physical Review Letters | 2006 |
| Finite-temperature properties of (Ba,Sr)TiO(3) systems from atomistic simulations | Physical Review B | 2006 |
| Influence of the growth direction on properties of ferroelectric ultrathin films | Physical Review B | 2006 |
| Controlling toroidal moment by means of an inhomogeneous static field: An ab initio study | Physical Review Letters | 2006 |
| Low-dimensional ferroelectrics under different electrical and mechanical boundary conditions: Atomistic simulations | Physical Review B | 2005 |
| Isostructural phase transitions in GaN/ScN and InN/ScN superlattices | Physical Review B | 2005 |
| Ferroelectricity of perovskites under pressure | Physical Review Letters | 2005 |
| First Principles Study of Size Effect in BaTiO3 Ultrathin Films | MRS Online Proceedings Library | 2005 |
| Phase diagrams of epitaxial BaTiO3 ultrathin films from first principles | Applied Physics Letters | 2005 |
| Modelling of nanoscale ferroelectrics from atomistic simulations | Current Opinion in Solid State & Materials Science | 2005 |
| Properties of GaN/ScN and InN/ScN superlattices from first principles | Physical Review B | 2005 |
| Study of potassium-sodium-niobate alloys: A combined experimental and theoretical approach | Journal De Physique Iv | 2005 |
| Morphotropic phase boundary of heterovalent perovskite solid solutions: Experimental and theoretical investigation of PbSc1/2Nb1/2O3-PbTiO3 | Physical Review B | 2005 |
| Atomistic treatment of depolarizing energy and field in ferroelectric nanostructures | Physical Review B | 2005 |
| Combined theoretical and experimental study of the low-temperature properties of BaZrO3 | Physical Review B | 2005 |
| Properties of Pb(Zr,Ti)O-3 ultrathin films under stress-free and open-circuit electrical boundary conditions | Physical Review B | 2004 |
| High-pressure phases in highly piezoelectric PbZr0.52Ti0.48O3 | Physical Review B | 2004 |
| Unusual phase transitions in ferroelectric nanodisks and nanorods | Nature | 2004 |
| Ultrathin films of ferroelectric solid solutions under a residual depolarizing field | Physical Review Letters | 2004 |
| Atomistic simulations of the incipient ferroelectric KTaO3 | Physical Review B | 2004 |
| Effects of atomic short-range order on the properties of perovskite alloys in their morphotropic phase boundary | Physical Review Letters | 2003 |
| Off-center atomic displacements in BaTiO3 quantum dots | Fundamental Physics of Ferroelectrics | 2003 |
| Cationic-competition-induced monoclinic phase in high piezoelectric (PbSc1/2Nb1/2O3)(1-x)-(PbTiO3)(x) compounds | Physical Review B | 2003 |
| First-principles study of (BiScO3)(1-x)-(PbTiO3)(x) piezoelectric alloys | Physical Review B | 2003 |
| First-principles determination of electromechanical responses of solids under finite electric fields | Physical Review Letters | 2003 |
| Ferroelectricity in barium titanate quantum dots and wires | Physical Review Letters | 2003 |
| Unusual thermodynamic properties and nonergodicity in ferroelectric superlattices | Physical Review Letters | 2003 |
| Strained hexagonal ScN: A material with unusual structural and optical properties | Physical Review Letters | 2003 |
| Electronic and magnetic properties of MnN versus MnAs | Applied Physics Letters | 2003 |
| Properties of vacancy-rich ordered (A,[ ])Nb2O6 perovskites | Physical Review B | 2002 |
| Effects of antiphase boundaries on the structural properties of highly ordered perovskite solid solutions | Fundamental Physics of Ferroelectrics 2002 | 2002 |
| Successes and predictions of a pseudopotential approach in anion-mixed nitrides | Progress in Semiconductor Materials for Optoelectronic Applications | 2002 |
| Global and secondary ferroelectric minima in ordered Pb(Sc0.25Nb0.25Ti0.5)O-3 alloys | Applied Physics Letters | 2002 |
| Pseudopotential theory of dilute III-V nitrides | Semiconductor Science and Technology | 2002 |
| Properties of hexagonal ScN versus wurtzite GaN and InN | Physical Review B | 2002 |
| Low-temperature properties of Pb(Zr1-xTix)O-3 solid solutions near the morphotropic phase boundary | Ferroelectrics | 2002 |
| Optical phonons associated with the low-temperature ferroelectric properties of perovskite solid solutions | Physical Review B | 2002 |
| Piezoelectric coefficients of complex semiconductor alloys from first-principles: The case of Ga1-xInxN | Physical Review Letters | 2002 |
| Planar defects and incommensurate phases in highly ordered perovskite solid solutions | Physical Review Letters | 2002 |
| Piezoelectricity of ferroelectric perovskites from first principles | Current Opinion in Solid State & Materials Science | 2002 |
| Ab initio design of perovskite alloys with predetermined properties: The case of Pb(Sc0.5Nb0.5)O-3 | Physical Review Letters | 2001 |
| Piezoelectricity of ordered (Ga0.5In0.5)N alloys | Applied Physics Letters | 2001 |
| Temperature-dependent behavior of PbSc1/2Nb1/2O3 from first Principles | Fundamental Physics of Ferroelectrics 2001 | 2001 |
| Anomalous properties in ferroelectrics induced by atomic ordering | Nature | 2001 |
| Electric-field induced polarization paths in Pb(Zr1-xTix)O-3 alloys | Physical Review B | 2001 |
| Structural properties of sinusoidally modulated Pb(Sc,Nb)O-3 alloys at finite temperature | Fundamental Physics of Ferroelectrics 2001 | 2001 |
| Composition modulation away from the polar direction in Pb(Sc,Nb)O-3 alloys | Physical Review B | 2001 |
| Virtual crystal approximation revisited: Application to dielectric and piezoelectric properties of perovskites | Physical Review B | 2000 |
| Quantum mechanical effects in (Ga,In)(As,N) alloys | Physical Review B | 2000 |
| Finite-temperature investigation of ferroelectric solid solutions from first-principles: Application to the structural properties of Pb(Zr0.5Ti0.5)O-3 | Fundamental Physics of Ferroelectrics 2000 | 2000 |
| Unusual evolution of the lowest unoccupied state in Ga(As0.5-yP0.5-yN2y) | Physical Review B | 2000 |
| Finite-temperature properties of disordered and ordered Pb(Sc0.5Nb0.5)O-3 alloys | Applied Physics Letters | 2000 |
| Comparison of electromechanical properties of BaTiO3 between LAPW and a model Hamiltonian | Fundamental Physics of Ferroelectrics 2000 | 2000 |
| Finite-temperature properties of Pb(Zr1-xTix)O-3 alloys from first principles | Physical Review Letters | 2000 |
| Microscopic view of a two-dimensional lattice-gas Ising system within the grand canonical ensemble | Physical Review Letters | 2000 |
| Intrinsic piezoelectric response in perovskite alloys: PMN-PT versus PZT | Physical Review Letters | 1999 |
| Band gaps of lattice-matched (Ga,In)(As,N) alloys | Applied Physics Letters | 1999 |
| Resonant hole localization and anomalous optical bowing in InGaN alloys | Applied Physics Letters | 1999 |
| Giant linear magnetoelectric effect at the morphotropic phase boundary of epitaxial Sr0.5Ba0.5MnO3 films | PHYSICAL REVIEW B | |
| Topology turns the crank on a magnetoelectric switch | Nature | |
