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Abstract：
The adsorption of Fe(CO)4 on various types of boron nitride nanotubes (BNNTs) are investigated by employing density functional theory. Our results indicate that Fe(CO)4 prefers to adsorb on the top of nitrogen atom via Fe atom, and the electronic property analysis indicates that the adsorption of Fe(CO)4 can reduce the band-gap of BNNTs.
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Jiegou Huaxue
ISSN： 0254-5861
CN： 35-1112/TQ
Year： 2008
Issue： 8
Volume： 27
Page： 1009-1012
0 . 6 4 3
JCR@2008
5 . 9 0 0
JCR@2023
ESI Discipline： CHEMISTRY;
JCR Journal Grade：3
Cited Count：
WoS CC Cited Count： 0
SCOPUS Cited Count：
ESI Highly Cited Papers on the List： 0 Unfold All
WanFang Cited Count：
Chinese Cited Count：
30 Days PV： 3
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