Higher-harmonic components of spin-orbit torque in Weyl ferromagnets enable deterministic magnetization reversal without external fields or additional symmetry breaking.
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Presents a multichannel active-space embedding framework coupling atomic multiplets to plane-wave photoelectrons in DFT/PAW for computing core-level spectra via time-domain autocorrelation, validated quantitatively on Ce N4,5 edges.
First-principles calculations map the effect of individual infrared-active phonon modes on the magnetic exchange parameters of Y3Fe5O12 via changes in Fe-O-Fe geometry.
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Multichannel active-space embedding of atomic multiplets in plane-wave DFT/PAW for core-level spectroscopies
Presents a multichannel active-space embedding framework coupling atomic multiplets to plane-wave photoelectrons in DFT/PAW for computing core-level spectra via time-domain autocorrelation, validated quantitatively on Ce N4,5 edges.