Density Functional Study of the Adsorption of Methanol and its Derivatives on Boron Nitride Nanotubes
Changes in the structural and electronic properties of chemically modified boron nitride nanotubes (BNNTs) using methanol and its derivatives including CH 3 CH 2 CH 2 OH CH 3 CH 2 OH, (ph)CH 2 CH 2 OH, CH 2 COOH and (CN)CH 2 CH 2 OH were investigated using density functional theory calculations. The...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
SAGE Publications
2013-09-01
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| Series: | Adsorption Science & Technology |
| Online Access: | https://doi.org/10.1260/0263-6174.31.9.767 |