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Creators/Authors contains: "Monserrat, Bartomeu"

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  1. Copper-doped lead apatite, called LK-99, was initially claimed to be a room temperature superconductor driven by flat electron bands, but was later found to be a wide gap insulator. Despite the lack of room temperature superconductivity, there is growing evidence that LK-99 and related compounds host various strong electron correlation phenomena arising from their flat electron bands. Depending on the copper doping site and crystal structure, LK-99 can exhibit two distinct flat bands crossing the Fermi level in the non-interacting limit: either a single or two entangled flat bands. We explore potential correlated metallic and insulating phases in the flat bands of LK-99 compounds by constructing their correlation phase diagrams, and find both non-Fermi liquid and Mott insulating states. We demonstrate that LK-99 is a charge-transfer Mott insulator driven by strong electron correlations, regardless of the flat band type. We also find that the non-Fermi liquid state in the multi-flat band system exhibits strange metal behaviour, while the corresponding state in the single flat band system exhibits pseudogap behaviour. Our findings align with available experimental observations and provide crucial insights into the correlation phenomenology of LK-99 and related compounds that could arise independently of superconductivity. Overall, our research highlights that LK-99 and related compounds offer a compelling platform for investigating correlation physics in flat band systems. 
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    Free, publicly-accessible full text available November 11, 2025
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  3. Abstract Monolayer transition-metal dichalcogenides (TMDCs) show a wealth of exciton physics. Here, we report the existence of a new excitonic species, the high-lying exciton (HX), in single-layer WSe 2 with an energy of ~3.4 eV, almost twice the band-edge A-exciton energy, with a linewidth as narrow as 5.8 meV. The HX is populated through momentum-selective optical excitation in the K -valleys and is identified in upconverted photoluminescence (UPL) in the UV spectral region. Strong electron-phonon coupling results in a cascaded phonon progression with equidistant peaks in the luminescence spectrum, resolvable to ninth order. Ab initio GW -BSE calculations with full electron-hole correlations explain HX formation and unmask the admixture of upper conduction-band states to this complex many-body excitation. These calculations suggest that the HX is comprised of electrons of negative mass. The coincidence of such high-lying excitonic species at around twice the energy of band-edge excitons rationalizes the excitonic quantum-interference phenomenon recently discovered in optical second-harmonic generation (SHG) and explains the efficient Auger-like annihilation of band-edge excitons. 
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