Non bonded interaction between BnNn (stator) and BN(-,0,+)B (rotor) systems: A quantum rotation in IR region

MONAJJEMI, Majıd

doi:10.1016/j.chemphys.2013.07.014

Non bonded interaction between B_nN_n (stator) and BN^(-,0,+)B (rotor) systems: A quantum rotation in IR region

Yazarlar (1)

Prof. Dr. Majıd MONAJJEMI The University Of Texas At Austin, Amerika Birleşik Devletleri

Makale Türü	Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı	Chemical Physics (Q2)
Dergi ISSN	0301-0104 Dergi Bilgileri (2013)
Makale Dili	İngilizce	Basım Tarihi	11-2013
Cilt / Sayı / Sayfa	425 / 1 / 29–45	DOI	10.1016/j.chemphys.2013.07.014
Makale Linki	http://www.scopus.com/inward/record.url?eid=2-s2.0-84884482444&partnerID=MN8TOARS
UAK Araştırma Alanları

Özet

The electromagnetic non-bonded interactions of BN^(-,0,+)B molecule as a quantum rotor inside several of BnNn molecular rings as a stator has been investigated by using EPR-II and EPR-III basis sets. Optimized structures, relative stability and hyperfine spectroscopic parameters, have been calculated. In this study, we have shown that the B nNn-BNB systems can be works as a nano rotor-stator molecular motor for the biological systems. Although in our previous works, we have discussed (Monajjemi et al. (2010) [20] and Monajjemi and Boggs (2013) [18]) of the stability and electromagnetic properties of some kind of B nNn rings, using of these systems as a detector are much more significant and have investigated in this work. The study for the B nNn-BN^(-,0,+)B systems and then for Adenine-Thymine and Guanine-Cytosine base pairs coupled with BN ^(-,0,+)B inside the BnNn (n = 8, 12, 15, 16, 18, 20, 24) have been investigated. Three quantized rotational frequencies in cationic, radical, and anionic forms have been calculated and all frequencies appeared in the IR rotational region. © 2013 Elsevier B.V. All rights reserved.

Anahtar Kelimeler

Science Direct

BM Sürdürülebilir Kalkınma Amaçları

Atıf Sayıları
Web of Science	89
Scopus	160

Non bonded interaction between B_nN_n (stator) and BN^(-,0,+)B (rotor) systems: A quantum rotation in IR region

Dergi Adı	CHEMICAL PHYSICS
Kısa Adı	CHEM PHYS
Yayıncı	ELSEVIER SCIENCE BV
Açık Erişim	Hayır
ISSN	0301-0104
E-ISSN	1873-4421
Wos Quartile	Q2
Scopus Quartile	Q2
Tarandığı Indeksler	SCIE , Scopus
WoS Kategoriler	CHEMISTRY, PHYSICAL \| PHYSICS, ATOMIC, MOLECULAR & CHEMICAL
Scopus Kategoriler	PHYSICAL AND THEORETICAL CHEMISTRY \| PHYSICS AND ASTRONOMY (MISCELLANEOUS)

Non bonded interaction between BnNn (stator) and BN(-,0,+)B (rotor) systems: A quantum rotation in IR region

Paylaş

Non bonded interaction between B_nN_n (stator) and BN^(-,0,+)B (rotor) systems: A quantum rotation in IR region