The chemical shielding and magnetizability relationship in potassium-doped (5,0) zigzag SWCNT nanotube
In this study, the relationship between daimagnetic shielding (σd), paramagnetic shielding (sp+s´p) and 13C isotropic shielding tensors 13C(σiso) with Mulliken, NBO and QTAIM atomic charges and also the relationship between chemical shielding and magnetizability in (5,0) zigzag single Walled Carbon...
| Main Authors: | , , |
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| Format: | Article |
| Language: | English |
| Published: |
Isfahan University of Technology
2020-11-01
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| Series: | Iranian Journal of Physics Research |
| Subjects: | |
| Online Access: | http://ijpr.iut.ac.ir/article_1646_0f96480440114ada7fd8ae63ba8f965a.pdf |