Michele Kotiuga

Materials Design (France) — France

Engineering · Physical Sciences

14h-index1.1kcitations44works3.02yr avg
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Research Topics

Molecular Junctions and Nanostructures(12), Electronic and Structural Properties of Oxides(9), Magnetic and transport properties of perovskites and related materials(8), Ferroelectric and Piezoelectric Materials(7), Advanced Memory and Neural Computing(5)

Publications44 total

<i>Ab initio</i> functional-independent calculations of the clamped Pockels tensor of tetragonal barium titanate
Physical review. B./Physical review. B·2025· 1 citedOpen Access
Hydrogen-induced tunable remanent polarization in a perovskite nickelate
Nature Communications·2024· 8 citedOpen Access
‘Fraternal-twin’ ferroelectricity: competing polar states in hydrogen-doped samarium nickelate from first principles
Journal of Physics Condensed Matter·2024Open Access
Understanding the role of Hubbard corrections in the rhombohedral phase of <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mi>BaTiO</mml:mi><mml:mn>3</mml:mn></mml:msub></mml:math>
Physical review. B./Physical review. B·2023· 18 citedOpen Access
Hydrogen-induced tunable remanent polarization in a perovskite nickelate
arXiv (Cornell University)·2023Open Access
Understanding the role of Hubbard corrections in the rhombohedral phase of BaTiO$_3$
arXiv (Cornell University)·2023· 1 citedOpen Access
Hybridization driving distortions and multiferroicity in rare-earth nickelates
Physical Review Research·2023· 14 citedOpen Access
Unraveling the effects of inter-site Hubbard interactions in spinel Li-ion cathode materials
arXiv (Cornell University)·2023Open Access
Unraveling the effects of inter-site Hubbard interactions in spinel Li-ion cathode materials
Physical Chemistry Chemical Physics·2023· 14 citedOpen Access
Hybridization driving distortions and multiferroicity in rare-earth nickelates
arXiv (Cornell University)·2022Open Access
Thermodynamics and dielectric response of BaTiO3 by data-driven modeling
npj Computational Materials·2022· 61 citedOpen Access
Analytical Theory of Near-Field Electrostatic Effects in Two-Dimensional Materials and van der Waals Heterojunctions
arXiv (Cornell University)·2022Open Access
Microscopic picture of paraelectric perovskites from structural prototypes
Physical Review Research·2022· 18 citedOpen Access
Thermodynamics and dielectric response of $\text{BaTiO}_3$ by data-driven modeling
arXiv (Cornell University)·2021Open Access
Engineering the Electronic Structure of Two-Dimensional Materials with Near-Field Electrostatic Effects of Self-Assembled Organic Layers
arXiv (Cornell University)·2021· 1 citedOpen Access
A microscopic picture of paraelectric perovskites from structural prototypes
arXiv (Cornell University)·2021· 1 citedOpen Access
Tuning the Electronic Structure of Two-Dimensional Materials through Molecular Assembly
Bulletin of the American Physical Society·2021
Unconventional ferroelectricity from competing states in perovskites
Bulletin of the American Physical Society·2021
"Fraternal-twin" ferroelectricity: competing polar states in hydrogen-doped samarium nickelate from first principles
arXiv (Cornell University)·2020Open Access
Charge transfer in iridate-nickelate superlattices
Bulletin of the American Physical Society·2020
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Frequent Co-authors

Karin M. Rabe(14), Jeffrey B. Neaton(12), Nicola Marzari(11), Pierre Darancet(10), Shriram Ramanathan(8), Hua Zhou(7), Latha Venkataraman(6), Iurii Timrov(6), Badri Narayanan(5), Mathew J. Cherukara(5), Jiarui Li(5), Riccardo Comin(5), J. W. Freeland(4), Subramanian K. R. S. Sankaranarayanan(4), Giovanni Pizzi(4), Heung‐Sik Kim(4), David Vanderbilt(4), Yifei Sun(3), Fan Zuo(3), Priyadarshini Panda(3)