Nano Structure Study on the First Series Transition Cations Inside B16N16-Nanotube in Point of Electromagnetic Interaction
Yazarlar (4)
Prof. Dr. Majıd MONAJJEMI Islamic Azad University, Science And Research Branch, İran
M. Seyedhosseini Islamic Azad University, Science And Research Branch, İran
M. Mousavi Islamic Azad University, Science And Research Branch, İran
Z. Jamali
Islamic Azad University, Science And Research Branch, İran
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Fullerenes Nanotubes and Carbon Nanostructures (Q3)
Dergi ISSN 1536-383X Dergi Bilgileri (2014)
Makale Dili İngilizce Basım Tarihi 10-2014
Cilt / Sayı / Sayfa 22 / 9 / 798–808 DOI 10.1080/1536383X.2012.742425
Makale Linki http://www.scopus.com/inward/record.url?eid=2-s2.0-84896343412&partnerID=MN8TOARS
UAK Araştırma Alanları
Özet
The effect of electromagnetic interaction of transition cations inside the B16N16 nanotube has been investigated with theoretical methods. First, calculations have been conducted to systemically investigate the stability and magnetic properties of d orbitals transitional-metal cations through doped in the B16N16 nanotube. After calculating the total energy and band gap of energy in the nanotubes B16N 16(X2+) (X = from Sc to Zn), we have plotted graphs of total energy and band gap changes in terms of the atomic number. Then, we calculated the potential difference between the central cations with atoms of nitrogen and boron nanotube body. We plotted as a graph the potential difference in terms of quantities such as dipole moment and quadrupole moment and the atomic number and the total energy and the gap of energy. Also, we have studied orbital splitting and Jahn-Teller distortions in nanotube field for d-orbitals of metal transition cations. © 2014 Copyright Taylor & Francis Group, LLC.
Anahtar Kelimeler
Boron nitride nanotubes | Cations | Electrical potential | Gap of energy | Transition
BM Sürdürülebilir Kalkınma Amaçları
Atıf Sayıları
Web of Science 1
Scopus 9
Nano Structure Study on the First Series Transition Cations Inside B16N16-Nanotube in Point of Electromagnetic Interaction

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  • Kastamonu Üniversitesi Rektörlüğü, Kuzeykent Kampüsü, Merkez/Kastamonu
  • unis@kastamonu.edu.tr 03662801000
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