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20052026
most citedAn electronic model for self-assembled hybrid organic/perovskite semiconductors: reverse band edge electronic states ordering and spin-orbit coupling

218 citations

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cond-mat.mtrl-sci2026

Energy level alignment of vacancy-ordered halide double perovskites

Ibrahim Buba Garba, George Volonakis

Vacancy-ordered double perovskites have emerged as lead-free alternatives, offering remarkable stability and compositional tunability for optoelectronic applications. In this study…

cond-mat.mtrl-sci2026

Emergent 3D Fermiology and Magnetism in an Intercalated Van der Waals System

Luigi Camerano, Emanuel A. Martínez, Victor Porée +16

Intercalation of magnetic atoms into van der Waals materials provides a versatile platform for tailoring unconventional magnetic properties. However, its impact on electronic dimen…

cond-mat.mtrl-sci2025★ 4 cited

Roadmap for electronic structure, anharmonicity, and electron-phonon calculations in locally disordered inorganic and hybrid halide perovskites

Marios Zacharias, George Volonakis, Laurent Pedesseau +3

The role of data in modern materials science becomes more valuable and accurate when effects such as electron-phonon coupling and anharmonicity are included, providing a more reali…

cond-mat.mtrl-sci2025★ 3 cited

Electron-phonon couplings in polymorphous crystals

Marios Zacharias, George Volonakis, Laurent Pedesseau +3

Positional polymorphism in solids refers to locally disordered unit cells that, on average, reproduce the high-symmetry structures observed in diffraction experiments. Standard the…

cond-mat.mtrl-sci2025

Empirical approaches to Fröhlich excitonic polarons in polar semiconductors

Jacky Even, Simon Thebaud, Aseem Rajan Kshirsagar +4

The excitonic correlation between electron and hole and these carriers' interactions with underlying crystal lattice govern the opto-electronic response of semiconductors. The latt…

cond-mat.mtrl-sci2025

Two-dimensional perovskites with maximum symmetry enable exciton diffusion length exceeding 2 micrometers

Jin Hou, Jared Fletcher, Siedah J. Hall +15

Realizing semiconductors with high symmetry of their crystallographic structures has been a virtue of inorganic materials and has resulted in novel physical behaviors. In contrast,…