NMR shielding tensors and thermodynamic investigation of B10 N11 nanocone structures
Yazarlar (3)
Dr. Öğr. Üyesi Fatemeh MOLLAAMIN Islamic Azad University, Science And Research Branch, İran
S. Mohajeri
Islamic Azad University, Science And Research Branch, İran
Islamic Azad University, Science And Research Branch, İran
Prof. Dr. Majıd MONAJJEMI Islamic Azad University, Science And Research Branch, İran
| Makale Türü | Özgün Makale (Uluslararası alan indekslerindeki dergilerde yayınlanan tam makale) | ||
| Dergi Adı | International Journal of Physical Sciences | ||
| Dergi ISSN | 1992-1950 | ||
| Dergi Tarandığı Indeksler | |||
| Makale Dili | İngilizce | Basım Tarihi | 01-2011 |
| Cilt / Sayı / Sayfa | 6 / 16 / 4067–4074 | DOI | – |
| Makale Linki | http://www.scopus.com/inward/record.url?eid=2-s2.0-80052664268&partnerID=MN8TOARS | ||
| Özet |
| Density functional theory (DFT) and HF are carried out at B3LYP/3-21G/6-31G/6-31G*/6-311G* level of theory to investigate the stability and ground state of B |
| Anahtar Kelimeler |
| Density functional theory (DFT) | Nanocone | NMR shielding tensors |
