S. Reyes-Lillo

发表

Antiferroelectricity in thin-film ZrO2 from first principles

K. Rabe, K. Garrity, S. Reyes-Lillo, 2014, 1403.3878.

"Double-path"ferroelectrics and the sign of the piezoelectric response

K. Rabe, Y. Qi, S. Reyes-Lillo, 2022, 2204.06999.

Reducing Coercive-Field Scaling in Ferroelectric Thin Films via Orientation Control.

Zuhuang Chen, J. Neaton, L. Martin, 2018, ACS nano.

UC Berkeley Previously Published Works Title Discovery and Characterization of a Pourbaix-Stable , 1 . 8 eV Direct Gap Bismuth Manganate

Kristin A. Persson, S. Suram, J. Gregoire, 2017 .

Lawrence Berkeley National Laboratory Recent Work Title Facet-dependent photovoltaic efficiency variations in single grains of hybrid halide perovskite Permalink

D. F. Ogletree, F. Toma, I. Sharp, 2016 .

Formation of the layered conductive magnet CrCl2(pyrazine)2 through redox-active coordination chemistry

J. Neaton, J. Long, Michael L. Aubrey, 2018, Nature Chemistry.

1 A Non-Innocent Coordination Chemistry Approach to 2 D Conductive Magnets

J. Neaton, J. Long, Michael L. Aubrey, 2017 .

A Non-Innocent Coordination Chemistry Approach to 2D Conductive Magnets

J. Neaton, J. Long, Michael L. Aubrey, 2017 .

Electron delocalization and charge mobility as a function of reduction in a metal–organic framework

Samia M. Hamed, J. Neaton, J. Long, 2018, Nature Materials.

and charge mobility as a function of reduction in a metal-organic framework.

Samia M. Hamed, J. Neaton, Peidong Yang, 2018 .

From an antiferromagnetic insulator to a strongly correlated metal in square-lattice MCl2(pyrazine)2 coordination solids

J. Neaton, J. Long, B. Vignolle, 2022, Nature Communications.

Full-Space Potential Gradient Driven Charge Migration inside BiFeO3 Photocathode

E. Menéndez-Proupin, S. Reyes-Lillo, Zemin Zhang, 2022, ACS Energy Letters.

Lead-free antiferroelectric: xCaZrO3-(1 -x)NaNbO3 system (0 ≤x≤ 0.10).

C. Randall, K. Rabe, H. Shimizu, 2015, Dalton transactions.

An automatically curated first-principles database of ferroelectrics

Anubhav Jain, Jeffrey B. Neaton, Tess E. Smidt, 2020, Scientific Data.

Discovery and Characterization of a Pourbaix-Stable, 1.8 eV Direct Gap Bismuth Manganate Photoanode

S. Suram, Lan Zhou, J. Gregoire, 2017 .

Discovery and Characterization of a Pourbaix-Stable , 1 . 8 eV Direct Gap Bismuth

S. Suram, Lan Zhou, J. Gregoire, 2017 .

Ferroelectricity in Pb1+δZrO3 Thin Films

Zuhuang Chen, J. Neaton, Hua Zhou, 2017 .

Ferroelectricity in Pb1+delta ZrO3 Thin Films

Zuhuang Chen, L. Martin, Jieun Kim, 2017 .

Ferroelectricity in Pb 1+ δ ZrO 3 Thin Films

Zuhuang Chen, L. Martin, Jieun Kim, 2017 .

Antiferroelectricity and ferroelectricity in epitaxially strained PbZrO 3 from first principles

K. Rabe, S. Reyes-Lillo, 2013, 1307.7645.

CuBi2O4: Electronic Structure, Optical Properties, and Photoelectrochemical Performance Limitations of the Photocathode

Yi-sheng Liu, S. Gul, Subhayan Roychoudhury, 2021 .

Electronic Structure and Performance Bottlenecks of CuFeO2 Photocathodes

F. Toma, I. Sharp, Yi-sheng Liu, 2019, Chemistry of Materials.

Ferroelectricity in [111]-oriented epitaxially strained SrTiO3 from first principles

J. Neaton, K. Rabe, S. Reyes-Lillo, 2018, Physical Review Materials.

Excited-state vibrational dynamics toward the polaron in methylammonium lead iodide perovskite

R. Mathies, J. Neaton, P. Yang, 2018, Nature Communications.

Physical Origins of the Transient Absorption Spectra and Dynamics in Thin-Film Semiconductors: The Case of BiVO4

Lucas H. Hess, I. Sharp, J. Neaton, 2018, The Journal of Physical Chemistry C.

Title Physical Origins of the Transient Absorption Spectra and Dynamics in Thin-Film Semiconductors : The Case of BiVO 4 Permalink

Lucas H. Hess, I. Sharp, J. Cooper, 2018 .

Facet-dependent photovoltaic efficiency variations in single grains of hybrid halide perovskite

D. F. Ogletree, F. Toma, I. Sharp, 2016, Nature Energy.

Critical Role of Methylammonium Librational Motion in Methylammonium Lead Iodide (CH3NH3PbI3) Perovskite Photochemistry.

R. Mathies, J. Neaton, P. Yang, 2017, Nano letters.

Electric Field- and Strain-Induced Rashba Effect in Hybrid Halide Perovskites.

J. Neaton, S. Reyes-Lillo, L. Leppert, 2016, The journal of physical chemistry letters.

Antiferroelectric negative capacitance from a structural phase transition in zirconia

Anthony A. Gaskell, Shimeng Yu, S. Slesazeck, 2021, Nature Communications.

Emergence of Rashba-/Dresselhaus effects in Ruddlesden–Popper halide perovskites with octahedral rotations

S. Reyes-Lillo, L. Leppert, S. Krach, 2022, Journal of physics. Condensed matter : an Institute of Physics journal.

Combinatorial alloying improves bismuth vanadate photoanodes via reduced monoclinic distortion

S. Suram, Lan Zhou, J. Gregoire, 2018 .

Understanding the Role of Oxygen and Hydrogen Defects in Modulating the Optoelectronic Properties of P-Type Metal Oxide Semiconductors

E. Xie, W. Han, J. Cooper, 2021, Chemistry of Materials.

Revealing Nanoscale Chemical Heterogeneities in Polycrystalline Mo-BiVO4 Thin Films.

F. Toma, I. Sharp, Subhayan Roychoudhury, 2020, Small.

Atomic-scale imaging of polarization switching in an (anti-)ferroelectric memory material: Zirconia (ZrO2)

A. Kummel, G. Leusink, R. Clark, 2020, 2020 IEEE Symposium on VLSI Technology.

Effects of quantum confinement on excited state properties of SrTiO 3 from ab initio many-body perturbation theory

T. Rangel, J. Neaton, F. Bruneval, 2016, 1605.01818.

A Janovec‐Kay‐Dunn‐Like Behavior at Thickness Scaling in Ultra‐Thin Antiferroelectric ZrO2 Films

M. Tian, N. Bassiri‐Gharb, A. Khan, 2021, Advanced Electronic Materials.

A Non-Innocent Coordination Chemistry Approach to 2D Conductive Magnets

J. Neaton, J. Long, Michael L. Aubrey, 2017 .

Candidate ferroelectrics via ab initio high-throughput screening of polar materials

J. Neaton, S. Mack, S. Reyes-Lillo, 2024, npj Computational Materials.