arXiv 2026-05-08 EN Emergent Dynamic Magnetic Ground State in a Mixed 3d/5d Heavy Fermion System CaCu3Ir4O12 J. Ming · Abhisek Bandyopadhyay · G. B. G. Stenning · M. T. F. Telling +4
arXiv 2026-05-07 EN Polarizable atomic multipoles for learning long-range electrostatics Dongjin Kim · Daniel S. King · Yoonjae Park · Roya Savoj +3
arXiv 2026-05-07 EN Tuning charge-transport properties and magnetic order in metallic EuTiO₃₋δ Xing He · Chiou Yang Tan · Issam Khayr · Zach Van Fossan +8
arXiv 2026-05-05 EN Beyond lead halide perovskites: visible light photovoltaics with phase engineered bismuth-based oxide double-perovskites, Bi2MCrO6 (M = Fe, Mn) N P Vikas · Ranjit K Pradhan · Somdutta Mukherjee · Udai P Singh +3
arXiv 2026-05-05 EN Pressure induced Electronic and Structural Transition in Ba₂NiTeO₆ Bidisha Mukherjee · Supratik Mukherjee · Mrinmay Sahu · Bhagyashri Giri +4
arXiv 2026-05-04 EN A Unified microscopic picture of cation and anion migration in MAPbI₃ Viren Tyagi · Geert Brocks · Shuxia Tao
arXiv 2026-05-01 EN Kinetically Arrested Twin-Domain State in Formamidinium Lead Iodide Xia Liang · Milos Dubajic · Zezhu Zeng · Yang Lu +3
arXiv 2026-04-30 EN VibroML: an automated toolkit for high-throughput vibrational analysis and dynamic instability remediation of crystalline materials using machine-learned potentials Rogério Almeida Gouvêa · Gian-Marco Rignanese
arXiv 2026-04-28 EN Predicting challenging phase transitions with Bayesian active learning Lorenzo Bastonero · Gabriel Joalland · Chiara Cignarella · Lorenzo Monacelli +1
arXiv 2026-04-27 EN A step-by-step workflow to extract the genuine circular dichroism of thin films Franziska Schölzel · Arina Narudin · Aleksandra Ciesielska · Alexander Ehm +4
arXiv 2026-04-27 EN Characterizing Fill Factor Limitations in Perovskite-Silicon Tandem Solar Cells Yueming Wang · Nan Sun · Chris Dreessen · Gaosheng Huang +3
arXiv 2026-04-24 EN Chirality Transfer to the Magnetic Sublattice in the Hybrid Perovskite (R)-/(S)-3-Fluoropyrrolidinium Copper(II) Chloride Zheng Zhang · Mingyu Xu · Jose L. Gonzalez Jimenez · Stephen Zhang +3
arXiv 2026-04-23 EN Dynamical stability and multifunctional properties of Ni2+/Pr3+ co-doped CsPbCl3 perovskite: insights from first-principles lattice dynamics and carrier transport Sikander Azam · Asif Zaman · Qaiser Rafiq · Amin Ur Rahman +1
arXiv 2026-04-21 EN Griffiths-like phase, spin-phonon coupling, and exchange-bias in the disordered double perovskite GdSrCoMnO₆ Gyanti Prakash Moharana · Diptikanta Swain · Hanuma Kumar Dara · Debendra Prasad Panda +1
arXiv 2026-04-21 EN Intra- and Interlayer Excitonic Fine Structure of the Two-Dimensional Perovskite (PEA)₂PbI₄ Patrick Grenzer · Fabian Lie · Klaus H. Eckstein · Tobias Hertel +1
arXiv 2026-04-15 EN Anion Ordering and Phase Stability Govern Optical Band Gaps in BaZr(S,Se)3 Erik Fransson · Michael Xu · Prakriti Kayastha · Kevin Ye +5
arXiv 2026-04-15 EN Probing local coordination and halide miscibility in single-, double-, and triple-halide perovskites using EXAFS Sonia S. Mulgund · Esther Y. -H. Hung · Leslie Bostwick · Ashley Galbraith +3
arXiv 2026-04-14 EN Topographic patterning in perovskite oxide membranes for local control of strain, nanomechanics and electronic structure Marti Ramis · Markos Paradinas · Jose M. Caicedo · Claudio Cazorla +2
