Lowest-Energy Structures of Water Clusters (H 2 O) 11 and (H 2 O) 13
✍ Scribed by Bulusu, Satya; Yoo, Soohaeng; Aprà, Edo; Xantheas, Sotiris; Zeng, Xiao Cheng
- Book ID
- 125995394
- Publisher
- American Chemical Society
- Year
- 2006
- Tongue
- English
- Weight
- 108 KB
- Volume
- 110
- Category
- Article
- ISSN
- 1089-5639
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📜 SIMILAR VOLUMES
The structures and stabilities of 24-, 25-and 26-mer water clusters were studied by applying the intermediate neglect of differential overlap self consistent field restricted Hartree-Fock method (INDO SCF RHF) after parametrization for H and O atoms. The 24-mer tetrakaidecahedral cage structure is m
The 26, 27 and 28 mer pentakaidecahedral water clusters were studied by applying the intermediate neglect of differential overlap self-consistent field restricted Hartree-Fock method (INDO SCF RHF) after parameterization for H and O atoms. The 27 and 28 met clusters have one and two water molecules