Figure 3
From: Circular dichroism of relativistically–moving chiral molecules
Optimised geometries of (a) chlorophyll a and (b) chlorophyll b in a COSMO model for water. White, grey, blue, red, and green balls represent hydrogen, carbon, nitrogen, oxygen, and magnesium atoms, respectively. (c) UV molar absorption spectra of both chlorophyll molecules reconstructed from dynamic polarisabilities. A Lorentzian broadening of 0.03 eV at HWHM was used. (d) UV ACD molar spectra of chlorophyll a and b reconstructed from dynamic polarisabilities. The same broadening as in (c) was used.
