Adsorption of Ethanol by Using BN Nanotube: A DFT Study
Electrical sensitivity of a boron nitride nanotube (BNNT) was examined toward C<sub>2</sub>H<sub>5</sub>OH molecules by using density functional theory (DFT) calculations . It was founding that the adsorption energy(E<sub>ad</sub>) of ethanol on the pristine n...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
Iranian Chemical Science and Technologies Association
2014-01-01
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| Series: | International Journal of New Chemistry |
| Subjects: | |
| Online Access: | http://www.ijnc.ir/article_7205_4aac183e4d42013dd6d388fd3e0b7ad7.pdf |