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cond-mat.mtrl-sci2026
Classification of Metal - Insulator Transitions: Relating characteristic Properties to Quantum Chemical Bonding Descriptors
Tim Bartsch, Carl-Friedrich Schön, Dasol Kim +3
Pressure induced metal insulator transitions (MIT) are classified by the evolution of characteristic optoelectronic and vibrational properties calculated with density functional th…
cond-mat.mtrl-sci2026
Bonding Signatures of Incipient Electron Localization in Topological Chiral Semimetals Near the Metal-Insulator Transition
Felix Hoff, Jonathan Frank, Mohit Raghuwanshi +11
How do electronic localization and delocalization compete in solids beyond the traditional limiting cases of metals and iono-covalent insulators? Topological chiral semimetals (TCS…