DFT Study of Properties of Surface Passivated Silicon Nanoclusters di Siddheshwar Chopra, Bandana Rai edito da LAP Lambert Academic Publishing
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DFT Study of Properties of Surface Passivated Silicon Nanoclusters

EAN:

9783659491566

ISBN:

365949156X

Pagine:
56
Formato:
Paperback
Lingua:
Tedesco
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Descrizione DFT Study of Properties of Surface Passivated Silicon Nanoclusters

This book represents the computational work done on silicon nanoclusters, using the famous density functional theory and time dependent density functional theory. Density functional theory is a very popular tool used by scientists these days for verifying several crucial properties of the nanosized materialsHere the single atom surface passivation was done on the small sized silicon clusters. Further, the IR spectra, band gap and the absorption properties were studied.

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