Molecular Modeling of Biofuel Cells of BN Nanotube-FAD Structure
Yazarlar (4)
Dr. Öğr. Üyesi Fatemeh MOLLAAMIN
Kastamonu Üniversitesi, Türkiye
Prof. Dr. Fatma KANDEMİRLİ
Kastamonu Üniversitesi, Türkiye
Nayer T. Mohammadian
Islamic Azad University, Ardabil Branch, İran
Prof. Dr. Majıd MONAJJEMI
Kastamonu Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SCOPUS dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Russian Journal of Physical Chemistry A | ||
| Dergi ISSN | 0036-0244 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Exp, SCOPUS, CCR Database, Chemistry Server Reaction Center, Curation, Current Contents Physical Chemical & Earth Sciences, Essential Science Indicators, Reaction Citation Index, Reference Master, Sophia | ||
| Makale Dili | İngilizce | Basım Tarihi | 04-2022 |
| Cilt / Sayı / Sayfa | 96 / 1 / – | DOI | 10.1134/S0036024422140163 |
| Özet |
| Abstract: Boron nitride nanotube (BNNT) joint to Flavin adenine dinucleotide (FAD) makes a nano-biofuel cell due to the direct electron transfer principle which has been studied by density functional theory methods. Flavin adenine dinucleotide was immobilized on the boron nitride nanotube by linking a simulation water medium. In this work, it has been done the quantum chemical and computational methods to estimate the effect of boron nitride nanotube through electron charge transfer, electric properties including resistance, voltage, and current, conductivity, limiting conductivity, power and nuclear magnetic resonance parameters and thermochemical properties using a Nano-biofuel cell. The results of boron nitride nanotube can be used for generating electric power in lower resistances with the best agreement in linear correlation of voltage-current directly from sustainable fuel substrate such as Flavin adenine dinucleotide (FAD). In this investigation, the data explained that the feasibility of using boron nitride nanotube and Flavin adenine dinucleotide becomes the norm in electrochemical bio system applications. |
| Anahtar Kelimeler |
| biofuel cell | boron nitride nanotube | density functional theory | Flavin adenine dinucleotide | limiting conductivity | power | voltage--current |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| WoS | 1 |
| SCOPUS | 1 |