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Optical response of the Cu2S2 diamond core in Cu2II(NGuaS)2Cl2. - Matthias Witte; Benjamin Grimm-Lebsanft; Arne Goos; Stephan Binder; Michael Rübhausen; Martin Bernard; Adam Neuba; Serge I. Gorelsky; Uwe Gerstmann; Gerald Henkel; Wolf Gero Schmidt; Sonja Herres-Pawlis (J. Comput. Chem., 2016)