Sharif Digital Repository

Water treatment from industrial and domestic pollutants is one of the most important issues in recent decades. In the present research, simulation of water purification using single-layer graphene membrane were studied. The effects of nanopores diameter, applied pressure, concentration of contaminant ions, and functional groups on the amount of filtered water and ion rejection through the membrane were quantified. Contaminant ions including Na+, K+, Mg2+, Ca2+, and Cl- were dissolved in water. Based on the results, by increasing the pore diameter and applied pressure, more water would pass through the membrane. Also it was concluded that pores with functional groups have better performance... 

In this research convective heat transfer coefficient enhancement of nanofluids prepared from high surface area graphene has been investigated in laminar flow in the developing region. The nanofluid has been prepared from nanoporous graphene with high surface area and with concentration of 0.025 to 0.1 %wt. Deionized water has been used as the base fluid and a type of Ter-Polymer has been utilized as the surfactant. The results indicate that thermal conductivity of nanofluid with concentration of 0.1 %wt remains quite constant, with only %3.8 enhancement, while convective heat transfer coefficient improves significantly, with 34% enhancement. The behavior of this enhancement related to the... 

Distinguishing the structure of DNA is of outmost importance in the medicine and agriculture industry nowadays. Various methods have been suggested so far; however, high costs, incorrect results, and time-taking process are among main defects of them. Scientists try to find new ways for recognizing DNA structure and system in order to overcome such problems. One of these new methods is absorbing and passing DNA through Nano-pores in an electrolyte solution under the influence of an electrical field. The basis of this method is the ionized currents which occur due to the passing of DNA through Nano-pores. Because each DNA base pairs can form a barrier corresponding to a unique measured value,... 

Outer membrane proteins play the role of molecular machines in the outer membrane of bacteria to regulate their basic functions. These macromolecules have nano-scale dimensions and they are involved in the classifications of nano-machines and nano-pores. Protein structure is constructed of chain of amino acids. Coarse grained elastic network model of the protein introduces a network of selected point masses, which is located on α-carbon of each amino acid, linked together with harmonic springs that represent the interactions between residues, both the chemical (protein backbone) and physical bonds. Using the harmonic network potential and theory of mechanical vibration, normal modes of... 

In this projekt, nanophotocatalysts containing metal oxides and oxy-acids based on the nanoporous materials were synthesized. The photocatalytic properties of the prepared samples were evaluated by the photodegradation of day moleculs in photocatalytic systems. The catalytic results revealed that Ag3VO4/Cu-MOF/rGO exhibits noticeably an improvement in both efficiency and rate of AB92 photodegradation in comparison with the pure Ag3VO4. Using different scanning mechanisms for the catalytic properties of the synthesized nanocomposites, it was clearly demonstrated that the anionic superoxide plays a decisive role. Reduction of 4-NP in the presence of NaBH4 was also used to investigate... 

Nanocomposites are fabricated by incorporating nano-scale particles in polymer, metal, or ceramic matrices. Metal matrix nanocomposites are a new kind of materials which have shown superior mechanical features, such as high strength, stiffness, and hardness. However, they are not sensitive to high temperature, in contrast to the polymer matrix nanocomposites. Nanoporous materials, also, have wide range of applications in different fields, such as geology, biology, biomechanics, and electronic. Carbon Nanotubes (CNTs) have shown wonderful properties like high Young’s modulus, high resonance frequency and unique electrical behavior. Wonderful mechanical and electrical properties make CNTs... 

In this study, deactivation of Midrex reforming catalysts is evaluated kinetically by 3.5-year data of Mobarakeh Steel Company direct reduction site. The variation of Midrex catalyst’s structure is characterized by XRD and BET test. Two deactivation mechanism are characterized, methane cracking carbone deposition and sintering. The project results demonstrate that victorious mechanism is carbon deposition. The methane cracking carbone cause layer by layer deactivation of catalyst during 5.5 months. Although, XRD and BET showed pore volume and radius reduction and Ni crystal increasing, approximated constant activity of catalyst were approved by kinetic evaluation  

Poly vinylidene fluoride (PVDF) as a fluorine polymer with acceptable thermal, chemical and physical property attractive create attention in membrane technology for water treatment application. However, with differential surface free energy between PVDF and water (∆G_s=30 mJ/m^2) PVDF polymer is divided as a hydrophobic materials, that is one of the basic problem for PVDF polymer. Due to its hydrophobicity the water molecules repulsion away from hydrophobic PVDF membrane surface as a spontaneous process with an entropy increasing and therefore pollutant molecules with hydrophobic functional group have tendency to adsorb onto membrane surface and dominate the boundary layer. In recent years... 

Nanoporous metal-organic frameworks are among the new and advanced compounds that have attracted attention of researchers due to their unique properties such as high surface area, high porosity and regular structure. These compounds can catalyze and degrade pollutants. Due to the high consumption of organic compounds, especially textile dyes, the pollution caused by wastewater is increasing in various industries. Disposal of wastewater containing organic pollutants into aquatic environments can alter the natural color, change the taste of water and disturb the life of living organisms. If the dyes are left untreated in aquatic ecosystems, they can remain in the environment for a very long... 

Resistive pulse sensing (RPS) has proved to be a viable method for detection and characterization of micro and nano particles. This method works based on ionic current variation inside nanopores. Modern fabrication methods have introduced different nanopore geometries for resistive pulse sensors therefore studing the effects of geometry on sensing performance of nanaopores is important. Numerical simulation has been used to study a wide variation of nanopore’s geometry configurations and study the physics behind this phenomena. Based on the results, numerical simulation could be used as a fast and easy tool for size determination for nanopore. To compare the sensing performance of different... 

The advent of nanopore-based sensors based on resitive pulse sensing gave rise to a remarkable breakthrough in the detection and characterization of nanoscale species. The sensors can detect the species’concentration, size, and charge using the resistive pulse characteristics. Some strong correlations have been reported between the resitive pulse characteristics and the particle’s geometrical and physical properties. These correlations are commonly used to obtain information about the particles in commercial devices and research setups. The correlations, however, do not consider the simultaneous effect of influential factors such as particle shape, charge, and off-axis translocation, which... 

In recent years carbon nanotubes and other carbon nanostructures such as graphene sheets have attracted a lot of attention due to their unique mechanical, thermal and electrical properties. These structures can be used in desalination of sea water, removal of hazardous substances from water tanks, gases separation, and so on. The nano porous single layer graphene membranes are very efficient for desalinating water due to their very low thickness. In this study, the mechanism of passing water and salt ions through nano porous single-layer graphene membrane are simulated using classical molecular dynamics. In the simulation, in order to separate salt ions from the water, the effects of applied... 

Water plays an essential role in the daily lives of humans, plants, and animals. Due to the lack of safe water on the planet, in recent years there have been many challenges in the field of water treatment, which has made water desalination technology always one of the most advanced technologies. The most advanced technology in this field is the use of nanotechnology in water and wastewater treatment, especially the use of Membrane processes such as reverse osmosis. Unlike conventional reverse osmosis membranes, nanoporous membranes can ensure rapid water transfer during the displacement process. The purpose of this thesis is to introduce new monolayers that have an incredible performance in...