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Pure momentum-shift bulk photovoltaic effect in ferroelectric flat-band Mott insulators
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abstract
The shift current photovoltaic effect is conventionally understood as the real-space displacement of a wave packet induced by photoexcitation. However, this interpretation becomes insufficient in flat-band systems, where quasiparticles are too massive to accelerate in real space under the optical electric field. Here, we developed a physically consistent method to decompose the shift current into real-space and momentum-space components. A surprising pure momentum-space shift current is found theoretically in flat-band Mott insulator Nb$_3$X$_8$ (X = Cl, Br, I) monolayers. This work underscores that significant shift current responses can emerge even in systems with minimal interband polarization differences, highlighting the potential for exploring novel bulk photovoltaic effects in flat-band Mott insulators.
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Projector Method for Nonlinear Light-Matter Interactions and Quantum Geometry
A gauge-invariant projector formalism, implemented in the Wannier basis with finite-spread corrections, computes shift current and quantum geometry in real materials and matches established methods on GeS.
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