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DTU Chemistry, Technical University of Denmark, Kemitorvet Bldg. 207, 2800 Kongens Lyngby, Denmark
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Origin independence, a critical requirement for accurate hyper-Rayleigh scattering optical activity spectroscopy calculations, can be achieved using a velocity formulation, even with approximate wavefunctions.
Chiral molecules reveal orbital rotation upon ionization, a subtle electron correlation effect, through unexpected oscillations in photoelectron angular distributions near the Cooper minimum.
