Jokar, M., Safaralizadeh, M., Hadizadeh, F., Rahmani, F., Kalani, M. (2015). The Theoretical Study of Molecular Dynamics To Design An Ultra-nano- Filtration For Diazinon Removal In Water Median. test, 8(2), 111-116. doi: 10.21608/eajbsa.2015.12914
Mahmoud Jokar; Mohammad Hassan Safaralizadeh; Farzin H Hadizadeh; Fatemeh Rahmani; Mohammad Reza Kalani. "The Theoretical Study of Molecular Dynamics To Design An Ultra-nano- Filtration For Diazinon Removal In Water Median". test, 8, 2, 2015, 111-116. doi: 10.21608/eajbsa.2015.12914
Jokar, M., Safaralizadeh, M., Hadizadeh, F., Rahmani, F., Kalani, M. (2015). 'The Theoretical Study of Molecular Dynamics To Design An Ultra-nano- Filtration For Diazinon Removal In Water Median', test, 8(2), pp. 111-116. doi: 10.21608/eajbsa.2015.12914
Jokar, M., Safaralizadeh, M., Hadizadeh, F., Rahmani, F., Kalani, M. The Theoretical Study of Molecular Dynamics To Design An Ultra-nano- Filtration For Diazinon Removal In Water Median. test, 2015; 8(2): 111-116. doi: 10.21608/eajbsa.2015.12914

The Theoretical Study of Molecular Dynamics To Design An Ultra-nano- Filtration For Diazinon Removal In Water Median

Egyptian Academic Journal of Biological Sciences. A, Entomology
Article 13, Volume 8, Issue 2, October 2015, Pages 111-116    PDF (517.97 K)
Document Type: Original Article
DOI: 10.21608/eajbsa.2015.12914
Authors
Mahmoud Jokar1; Mohammad Hassan Safaralizadeh1; Farzin H Hadizadeh2; Fatemeh Rahmani3; Mohammad Reza Kalani4
1Departments of Entomology and Plant Pathology, University of Urmia, Urmia, Iran
2Mashhad University of Medical Sciences, Faculty of Medicine, Pharmacy, Mashhad, Iran
3Division of Genetic, Department of Biology, Urmia University, Urmia, Iran
4School of Medicine, Mashhad University of Medical Sciences, Mashhad, Iran
Abstract
Accumulation of pesticides in particular organophosphorus in water achieved a global warning. Therefore, acquiring technical knowledge on ultrafiltration is necessary in environmental purification. Theoretical designs are the first step in construction of a successful commercial product. In this research, three models of single-wall-carbon-nanotube (SWCNTs) were simulated by NAMD software to assess potential application as an adsorbent. Diazinon entrapping in SWCNTs is the desirable result. Three SWCNT models include: CNT 5,20 (diameter 5 nm, length 20 nm), CNT 10,20 (diameter 10 nm, length 20 nm) and CNT 10,20-SEM (diameter 10 nm, length 20 nm by flowing water and external electrical filed). The CNT 10,20-SEM demonstrated suitable entrapping process and potential ability to apply in industrial filtration.
Keywords
Diazinon; Molecular Dynamics; Single-Wall-Carbon-Nanotube (SWCNTs); Ultra-nano-filtration
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