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Calculation of optical absorption in Al across the solid-to-liquid transition

✍ Scribed by Benedict, Lorin X.; Klepeis, John E.; Streitz, Frederick H.


Book ID
120558236
Publisher
The American Physical Society
Year
2005
Tongue
English
Weight
70 KB
Volume
71
Category
Article
ISSN
1098-0121

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Some vibrational and electronic properties of the CuClz molecule are analyzed in order to characterize the electronic states and assign the bands seen on the optical absorption spectra. Equilibrium distances, total energies, electronic structure and harmonic vibrational frequencies of the low-lying