Cilt 18, Sayı 2, Sayfalar 398 - 402 2017-06-30

ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE

Metin Bilge [1]

105 74

Interaction mechanisms of doped fullerenes and various types of molecules have been paid increasing attention. In this research, absorption mechanism, structural and electronic properties, natural bond orbital analysis between pentylamine (pa) and doped (Si or Al) C60 fullerenes were investigated by quantum mechanical calculations. Bond order and binding energy results suggest that a chemisorption occur between nitrogen atom of pa and silicon/aluminum atoms of fullerene cages, examined complexes yielded with higher binding energy in water media and the system of AlC59…pa in water was found as having the highest binding energy.

Adsorption mechanism,Doped C60 fullerene,NBO,DFT
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Konular Mühendislik ve Temel Bilimler
Dergi Bölümü Araştırma Makalesi
Yazarlar

Yazar: Metin Bilge
E-posta: metin.bilge@ege.edu.tr
Kurum: EGE UNIV
Ülke: Turkey


Bibtex @araştırma makalesi { aubtda281646, journal = {Anadolu Üniversitesi Bilim Ve Teknoloji Dergisi A - Uygulamalı Bilimler ve Mühendislik}, issn = {1302-3160}, address = {Anadolu Üniversitesi}, year = {2017}, volume = {18}, pages = {398 - 402}, doi = {10.18038/aubtda.281646}, title = {ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE}, language = {en}, key = {cite}, author = {Bilge, Metin} }
APA Bilge, M . (2017). ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE. Anadolu Üniversitesi Bilim Ve Teknoloji Dergisi A - Uygulamalı Bilimler ve Mühendislik, 18 (2), 398-402. DOI: 10.18038/aubtda.281646
MLA Bilge, M . "ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE". Anadolu Üniversitesi Bilim Ve Teknoloji Dergisi A - Uygulamalı Bilimler ve Mühendislik 18 (2017): 398-402 <http://dergipark.gov.tr/aubtda/issue/29641/281646>
Chicago Bilge, M . "ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE". Anadolu Üniversitesi Bilim Ve Teknoloji Dergisi A - Uygulamalı Bilimler ve Mühendislik 18 (2017): 398-402
RIS TY - JOUR T1 - ADSORPTION MECHANISM AND STRUCTURAL INVESTIGATION OF DOPED C60 FULLERENES WİTH PENTYLAMINE AU - Metin Bilge Y1 - 2017 PY - 2017 N1 - doi: 10.18038/aubtda.281646 DO - 10.18038/aubtda.281646 T2 - Anadolu Üniversitesi Bilim Ve Teknoloji Dergisi A - Uygulamalı Bilimler ve Mühendislik JF - Journal JO - JOR SP - 398 EP - 402 VL - 18 IS - 2 SN - 1302-3160-2146-0205 M3 - doi: 10.18038/aubtda.281646 UR - http://dx.doi.org/10.18038/aubtda.281646 Y2 - 2017 ER -
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