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Raman spectra of small water clusters

โœ Scribed by M. A. Buldakova; I. I. Matrosov; T. N. Popova

Publisher
Springer US
Year
1986
Tongue
English
Weight
330 KB
Volume
44
Category
Article
ISSN
0021-9037

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Revisiting small clusters of water molec
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The geometries and relative energies of small clusters of water molecules, (HzO), with 4 < n G 8, are reported. For each value of n we have considered the conformations corresponding to the lowest-energy minimum and those in nearby relative minima. Thus we report on six tetramers, four pentamers, si

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Structures of the negatively charged water clusters H O with n up to 2 n 6 were optimized at the UHFr4-31 q q G\*\* level without any geometrical restriction. There was found a chainlike structure for the trimer anion and both chainlike and cyclic geometries for the larger clusters. According to t