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Calculated energy and conformation of clusters of benzene molecules and their relationship to crystalline benzene

✍ Scribed by Williams, D. E.


Book ID
114522807
Publisher
International Union of Crystallography
Year
1980
Weight
818 KB
Volume
36
Category
Article
ISSN
0567-7394

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Ab initio calculations on the structure,
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Excitation spectra of van der Waals (vdW) clusters show spectral shifts due to change in the stabilization energy in the ground and excited state. Ab initio calculations are applied to determine the structure and vibrational frequencies of vdW clusters like benzene...Ar and benzene...Ar 2 in the ele