Adsorption properties of acetone, acetoacetic acid and beta-hydroxybutyric acid on armchair (8, 8) gallium nitride nanotube: A Density Functional Theory approach
We have investigated the adsorption properties of biomolecule ketone bodies (acetone, acetoacetic acid and beta-hydroxybutyric acid) on armchair (8, 8) gallium nitride nanotube (GaNNT). Density functional theory (DFT) calculations at the B3LYP/6-31G level were performed throughout the study. The res...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2021-05-01
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| Series: | Results in Surfaces and Interfaces |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2666845921000118 |