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Electronic Impurity Doping of a 2D Hybrid Lead Iodide Perovskite by $Bi$ and $Sn$

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Sebastian Kokott ⁷, Christian Carbogno ⁷, Tianyang Li³, Glenn Teeter ¹, Matthias Scheffler ⁷, Joseph J. Berry^1,8,9, David B. Mitzi ^3,4, Jeffrey L. Blackburn ¹, Volker Blum ^3,4,*, and Matthew C. Beard ^1,8,†

¹Material Chemical and Computational Science Directorate, National Renewable Energy Laboratory, Golden, Colorado 80401, USA
²Department of Chemistry, The Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong SAR, China
³Thomas Lord Department of Mechanical Engineering and Material Science, Duke University, Durham, North Carolina 27708, USA
⁴Department of Chemistry, Duke University, Durham, North Carolina 27708, USA
⁵Lenovo HPC Innovation Center, Meitnerstr. 9, D-70563 Stuttgart, Germany
⁶Max Planck Computing and Data Facility, Giessenbachstrasse 2, D-85748 Garching, Germany
⁷The NOMAD Laboratory at the FHI of the Max-Planck-Gesellschaft and IRIS-Adlershof of the Humboldt-Universität zu Berlin, 14195 Berlin, Germany
⁸Renewable and Sustainable Energy Institute, University of Colorado Boulder, Boulder, Colorado 80309, USA
⁹Department of Physics, University of Colorado Boulder, Boulder, Colorado 80309, USA

^*volker.blum@duke.edu
^†Matt.Beard@nrel.gov

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Articles Citing

Electronic Impurity Doping of a 2D Hybrid Lead Iodide Perovskite by $Bi$ and $Sn$

Octahedral tilting and B-site off-centering in halide perovskites are not coupled

HOMO Offset Induced Hole Trapping in Conjugated Dion‐Jacobson Perovskites

Realizing Surface Acoustic Wave Device Based on 2D Ruddlesden‐Popper Perovskite: Exploring Acoustic and Acoustoelectric Characteristics

Bismuth-Induced Modulation of Vacancy Migration Enables Linear Synaptic Plasticity in 2D Perovskite Memristors

Dopant‐Engineered Enhancement of Third‐Harmonic Generation in 2D Hybrid Perovskites

Chiral Phonon-Induced Spin Transport via Microscopic Barnett Effect

Prediction of frontier band spin splitting in 2D perovskites via deep neural networks

Towards an interoperable perovskite description or how to keep track of 300 perovskite ions

Striking Differences in Regulating Effects on Electronic Transport of 2D Iodine-Based Devices from Metal and Nonmetal Dopants

Hot Electron Photocatalysis Using Nontoxic Self‐Doped Quantum Dots

Hot Electron Photocatalysis Using Nontoxic Self‐Doped Quantum Dots

Efficient all-electron hybrid density functionals for atomistic simulations beyond 10 000 atoms

Unraveling Rashba effect through spin-texture evolution in unidimensional-confined halide-perovskite under compression

Benchmark thermodynamic analysis of methylammonium lead iodide decomposition from first principles

Impact of tin doping on charge carrier dynamics of a two-dimensional lead halide perovskite

Extended Honeycomb Metal Chloride with Tunable Antiferromagnetic Correlations

Optical Studies of Doped Two-Dimensional Lead Halide Perovskites: Evidence for Rashba-Split Branches in the Conduction Band

Induced Circularly Polarized Luminescence and Exciton Fine Structure Splitting in Magnetic-Doped Chiral Perovskites

Structure and electronic tunability of acene alkylamine based layered hybrid organic-inorganic perovskites from first principles

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