Inelastic x-ray scattering shows soft phonons at the L-point drive the CDW in KV3Sb5 via momentum-dependent EPC, with anisotropy opposing that of electronic susceptibility.
Giustino ,\ 10.1103/RevModPhys.89.015003 journal journal Rev
2 Pith papers cite this work. Polarity classification is still indexing.
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A variational ab initio framework for electron and hole polarons that couples to all phonons, formulated as a nonlinear eigenvalue problem in Kohn-Sham and phonon bases and demonstrated on LiF and Li2O2 without supercells.
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Soft Phonon Charge-Density Wave Formation in the Kagome Metal KV$_3$Sb$_5$
Inelastic x-ray scattering shows soft phonons at the L-point drive the CDW in KV3Sb5 via momentum-dependent EPC, with anisotropy opposing that of electronic susceptibility.
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Ab initio theory of polarons: formalism and applications
A variational ab initio framework for electron and hole polarons that couples to all phonons, formulated as a nonlinear eigenvalue problem in Kohn-Sham and phonon bases and demonstrated on LiF and Li2O2 without supercells.