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Structural, energetic, and electronic properties of hydrogenated aluminum arsenide clusters

✍ Scribed by Ling Guo


Publisher
Springer Netherlands
Year
2010
Tongue
English
Weight
389 KB
Volume
13
Category
Article
ISSN
1388-0764

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We present extensive computational results on density functional Ε½ . Ε½ . calculations for hydrogen fluoride species HF with 1 F n F 6 and compare n them to results from other approaches and experiments, where available. Among the calculated properties we discuss equilibrium structural parameters, vi