Spin-Dependent Vibrational Spectra of the Gd@C60 Endohedral Metallofullerene |
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Authors: | Krisilov A. V. Nechaev I. V. Chernov V. E. Zon B. A. |
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Affiliation: | 1.Voronezh State University, 394018, Voronezh, Russia ;2.Air Force Academy Named after Professor N.E. Zhukovsky and Y.A. Gagarin, 394052, Voronezh, Russia ; |
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Abstract: | Optics and Spectroscopy - We present an ab initio calculation of the structures and the IR spectra of the endofullerene Gd@C60 in different spin states. The lines in the IR spectra of Gd@C60... |
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