Sharif Digital Repository

The effect of substitutional Li doping into NiOx hole transporting layer (HTL) for use in inverted perovskite solar cells was systematically studied. Li doped NiOx thin films with preferential crystal growth along the (111) plane were deposited using a simple solution-based process. Mott-Schottky analysis showed that hole carrier concentration (NA) is doubled by Li doping. Utilizing 4 % Li in NiOx improved the power conversion efficiency (PCE) of solar devices from 9.0 % to 12.6 %. Photoluminescence quenching investigations demonstrate better hole capturing properties of Li:NiOx compared to that of NiOx, leading to higher current densities by Li doping. The electrical conductivity of NiOx is... 

In this research, we investigate the effect of alkali metal cations including Li, Na and Cs in hydrothermal solution on the morphology, stability, and photoactivity of nanostructured TiO2 nanoflakes as a photoanode. The TiO2 nanoflakes are formed through hydrothermal treatment of Ti foil in 1.0 M LiOH, NaOH or CsOH at 100 °C for 3 h. By subsequent thermal reduction of the structure in an optimized Ar/H2 environment, conductive TiO2 nanoflakes were formed. The reduction treatment remarkably improves the photocurrent density of the TiO2 nanoflakes and has the highest impact on the sample treated in the NaOH alkali solution. For the nanoflakes produced in NaOH alkali solution, the bandgap is... 

In this work, cycling-induced aging occurring in 18650-type LiFePO4/graphite full cells at different C-rates is studied extensively. The mechanism of performance degradation is investigated using a combination of electrochemical and microstructural analyses. Half-cell studies are carried out after dismantling the full cells, using fresh and cycled LiFePO4 cathode and graphite anode to independently study them. The results show that the capacity of LiFePO4 electrodes is significantly recovered. The rate of capacity fading in the discharge state considered as irreversible capacity in the graphite is higher than LiFePO4 half cells, indicating a greater degradation in the performance of this... 

In this work, cycling-induced aging occurring in 18650-type LiFePO4/graphite full cells at different C-rates is studied extensively. The mechanism of performance degradation is investigated using a combination of electrochemical and microstructural analyses. Half-cell studies are carried out after dismantling the full cells, using fresh and cycled LiFePO4 cathode and graphite anode to independently study them. The results show that the capacity of LiFePO4 electrodes is significantly recovered. The rate of capacity fading in the discharge state considered as irreversible capacity in the graphite is higher than LiFePO4 half cells, indicating a greater degradation in the performance of this... 

This paper aims at the investigation of acoustic streaming produced by surface acoustic waves (SAWs) in a drop. Computational simulation of acoustofluidic phenomenon, using lattice Boltzmann method (LBM), presenting acoustic applications in flow control, and a relatively complete parametric study are the motivations of this work. For this purpose, a computational fluid dynamics modeling based on multi-relaxation time multi-component multiphase color gradient lattice Boltzmann method was used. The simulations were carried out at wave frequencies ranging from 20 MHz to 271 MHz and wave amplitudes ranging from 0.5 nm to about 350 nm. First, the non-dimensional form of Navier-Stokes equations... 

Cubic phase Li7La3Zr2O12 (LLZO) is a promising solid electrolyte for next-generation Li-ion batteries. In this work, the combustion sol–gel technique is used to prepare an Al-doped LLZO solid electrolyte. The crystal structure is investigated, and the cubic phase is confirmed. Densification properties were investigated using SEM and optical dilatometry. The densification of the Al-doped sample takes place in two stages through two different shrinkage rates. Using 0.25 mol Al-dopant 94% relative density is achieved at 1100 °C. The effect of Al-doping on electrochemical properties is investigated in detail using AC impedance spectroscopy. The result indicates that the optimum concentration of... 

Lithium ions play a crucial role in the energy storage industry. Finding suitable lithium-ion-conductive membranes is one of the important issues of energy storage studies. Hence, a perovskite-based membrane, Lithium Lanthanum Titanate (LLTO), was innovatively implemented in the presence and absence of solvents to precisely understand the mechanism of lithium ion separation. The ion-selective membrane’s mechanism and the perovskite-based membrane’s efficiency were investigated using Molecular Dynamic (MD) simulation. The results specified that the change in the ambient condition, pH, and temperature led to a shift in LLTO pore sizes. Based on the results, pH plays an undeniable role in... 

The main drawback of lithium-sulfur (Li-S) batteries which leads to a short lifetime, is the shuttle effect during the battery operation. One of the solutions to mitigate the shuttle effect is the utilization of interlayers. Herein, graphene oxide (GO) paper as an interlayer has been implemented between the sulfur cathode fabricated by the vapor deposition process as a binder-free electrode and a separator in a Li-S battery in order to gain a sufficient capacity. The morphological characteristics and electrochemical performance of the fabricated electrode have been investigated. The fabricated battery demonstrates an initial discharge capacity of 1265.46 mAh g-1 at the current density of 100... 

The current paper reports the deposition of sulfur micro-particles using sulfur vapor deposition (SVD). Sulfur particles in size of 5 to 45 μm were deposited on a stainless steel substrate to be used as the cathode with porous structure in lithium sulfur (Li-S) batteries. Mass loading of about 0.5 mg cm-2 was obtained from this pure sulfur cathode. The structure of this binder-free cathode was characterized by field emission scanning electron microscopy (FESEM), x-ray spectroscopy (EDS), and x-ray diffraction (XRD). The electrochemical performance of the battery with two different organic liquid ether- and carbonate-based electrolytes was investigated and the results demonstrated that the... 

This study has investigated the effect of carbon coating on the electrochemical performance of SnO2 Nanowires (NWs) as an electrode along with a bis (trifluoromethane) sulfonimide lithium (LiTFSI)-based electrolyte in a lithium-ion battery (LIB). The vapor-liquid-solid approach has been used to grow SnO2 NWs on the stainless steel mesh current collector. The obtained results have demonstrated that the utilization of the LiTFSI-based electrolyte improved the battery performance with the SnO2 NWs electrode over the LiPF6-based electrolyte. This may be due to the formation of a stable and thin solid electrolyte interphase layer. Since bare SnO2 NWs exhibit inferior cycling stability due to... 

Nowadays, the importance of the blood particles separation is undeniable in medical fields and there are different sorts of separation methods accordingly. Acoustic cell separation is chosen in this paper. Also, numerical methods have been used to study the effect of geometrical factors on the separation of the particles before spending time and expenses in a trial and error manner experimentally. We have implemented a plenary finite-element-based simulation of separatingblood particles such as white blood cells and platelets in an acoustic field using standing surface acoustic waves. In this paper, unlike previous works in which the channel is rectangular; the channel is trapezoidal in... 

This paper concentrates on degradation of electric vehicle (EV) lithium-ion batteries in vehicle-to-grid (V2G) programs and proposes a practical wear cost model for EVs charge scheduling applications. As the first step, all the factors affecting the cycle life of lithium-ion batteries are identified and their impacts on degradation process are investigated. Subsequently, a general model for battery loss of cycle life is devised incorporating all the pertinent factors associated with charging and discharging activities in V2G applications. Modeling the battery wear cost as a series of equal-payments over the cycle life, a mechanism for calculating the cost incurred by EV users due to... 

In this paper, we aim to account for the partitioning of finite sized ions and electric double layer (EDL) overlapping effects on the electrostatics and hydrodynamics of soft nanofluidics by stablishing a modified Poisson-Boltzmann (MPB) equation enjoying mean field approach. The application of the present MPB equation enables us to describe the interaction between the steric effect and electrostatic repulsion of EDL ions due to permittivity difference of polyelectrolyte layer (PEL) and electrolyte solution. Utilizing the Debye-Hückel approximation pertinent to low surface potentials, we analytically derive the solutions of electric potential and velocity profiles of mixed electroosmotic and... 

An intense decrease in cycling performance and safety is a challenge for elevated temperature application of LiNi0.5Co0.2Mn0.3O2 (NCM) cathode material. In this paper, effect of two types of nano-coatings on improvement of elevated temperature performance of NCM cathode material has been investigated. One of the coatings contains SiO2 nanoparticles and the other one contains composite of reduced graphene oxide and SiO2 nanoparticles (rGO-SiO2). The coatings were fabricated by a facile wet chemical method. The SiO2 coated cathode material showed an excellent elevated temperature cycling stability, however, a decrease in discharge capacity and rate capability of this sample was observed. On... 

A 1-D heterogeneous model of sorption-enhanced steam methane reforming (SE-SMR) process in a packed bed reactor consisting of nickel catalyst well mixed with CO2 sorbent particles is investigated for three types of common sorbents. The performance of SE-SMR process is studied under low medium pressure conditions (3 – 11 bar) to find the optimum operating conditions. Optimal CaO sorption corresponding to 82% CH4 conversion and 85% H2 purity is found at 900 K, 3 bar, 3.5 kgm−2s−1 and S/C of 3.0. In contrast, lithium zirconate (LZC) and hydrotalcite (HTC) sorbents exhibited best sorptions under the operating conditions of 773 K, 5 bar and S/C of 3 with CH4 conversion of 91.3% and 55.2%, and H2... 

The purpose of this article is to investigate the shielding performance of the B2O3-Bi2O3-ZnO-Li2O glasses against the gamma-ray. To this end, the attenuation parameters of the gamma-ray inside the B2O3-Bi2O3-ZnO-Li2O glasses were evaluated in the energy range of 200–1500 keV. It was found that the mass attenuation coefficient of the composites increases with increasing the Li2O content. The relative percent deviation between the results of simulation using the MCNPX and XCOM database in most cases was less than 2%. Additionally, the Mean Free Path (MFP) and Half-Value Layer (HVL) parameters were evaluated, and the shielding efficiency of samples was compared with some conventional shielding... 

We introduce an effective method for copper indium sulfide selenide (CISSe) doping with different alkali metals (Li, Na and K) based on a pre-deposited alkali chloride layer. A simple and fast spray method is used for pre-deposition of alkali chloride layer (LiCl, NaCl, KCl) on substrate surface before spray pyrolysis deposition of copper indium disulfide CuInS2 (CIS) films followed by selenization. The different properties of alkali-doped CISSe films by the alkali chloride pre-deposition (ACPD) method were compared to the post-deposition treatment (PDT) method. Based on FESEM images, a highly compact film with large grains can be obtained for CISSe films doped with K(∼0.72 μm) and Na (∼0.56... 

Titanium nitride/graphene nanocomposite as an anode material of lithium ion batteries has been fabricated through the reaction of TiCl4 and NaN3 in supercritical benzene medium followed by ammonia treating at 1000 °C for 10 h. The synthesized TiN/G nanocomposite depicts rate-dependent behavior in such a way that it shows specific capacity of 115 mAh g−1 when is cycled at higher rate (1.6 C) while it shows 76 mAh g−1 when is cycled initially at lower rate (0.2 C) and is subsequently subjected to higher rate (1.6 C). Moreover, TiN/G anode demonstrates capacity retention of 112%, 100%, and 70% after 250 cycles at charge/discharge rates of 1.6, 0.7, and 0.2 C, respectively. This unusual behavior... 

Na3MnCO3PO4 (NMCP) particles were synthesized via ball milling of Mn(NO3)2.4H2O, Na2HPO4.2H2O and Na2CO3.H2O powders. The particles were anchored onto reduced graphene oxide (rGO) sheets during hydrothermal reduction process under stirring. Materials produced were characterized by x-ray diffraction (XRD), Raman spectroscopy, field emission scanning electron microscopy (FESEM), transmission electron microscopy (TEM), thermogravimetric (TG) measurement and galvanostatic charge/discharge tests. Results showed that dissolution of ball milling products in DI water is an effective method for separation of NMCP from byproducts. Best milling time for production of pure NMCP of minimum particle... 

A straightforward three-stage method was applied to fabricate a super-hydrophobic mixed-matrix nanofiber membrane using the electrospinning method for desalination purpose. First, a hydrothermal technique was applied to synthesize a super-hydrophobic nano-sheet, called octadecylamine-reduced graphene oxide (ODA-rGO) with a water contact angle of 162°, which was then added to PVDF-HFP dope solution. After, 0.005 wt% LiCl was added to the dope solution to decrease the mean pore size by increasing solution conductivity. Moreover, some membranes were hot-pressed to improve liquid entry pressure (LEP). Eventually, a top-quality nanofiber membrane was synthesized using 0.1 wt% ODA-rGO and 0.005...