Sharif Digital Repository

One of the most relevant negative characteristics of high-capacity cathodes for lithium batteries is indeed non-flat voltage-time (V-t) or voltage-capacity (V-C) behaviour during charge-discharge. A clear rationale for this behaviour has not yet been addressed in the literature. Here, by means of density functional theory (DFT) calculations corroborated by basic experimental electrochemical characterization, we investigated both the thermodynamic and the kinetic aspects relevant to voltage variations during charge-discharge of Li2FeSiO4 intended as a model case. A simple physical model allowed us to take into account all the experimental evidence. We suggested that voltage deviations from... 

Li2FeSiO4 was synthesized through Sol–Gel method and the effect of calcination temperature, time and chelating agent concentration were investigated. Appropriate calcination temperature above 550 °C was determined by TG/DTA analysis. Afterward, the dried gel powder was calcined at each temperature of 650 °C, 700 °C and 750 °C for 1, 2 and 3 h. XRD studies illustrated the most appropriate calcination temperature of 700 °C for 1 h. To compare the effect of chelating agent concentration, citric acid with molar ratio of 1/3, 2/3 and 1 were used which 1/3 was determined as the best concentration. FE-SEM observation showed that mean grain is size lower than 100 nm. By using this material, a three... 

Titanium type lithium ion-sieve nanotubes synthesized by the hydrothermal method were extensively explored over recent years due to its promising properties. However, on account of nanotubes′ tangled structure impeding the lithium adsorption in the interior nanotube walls, unalterable dimensions of the synthesized nanotubes, and a long period of annealing, the anodizing technique was proposed. It is shown that lithium uptake and adsorption capacity is improved because of easier mass transfer during the ion exchange process. This work focuses on a novel anodizing method for nanotube ion-sieve synthesis. The optimum anodizing condition was discovered by altering anodizing voltage, time, and... 

The anode materials are one of the critical components in rechargeable lithium ion batteries (LIBs). The monoclinic tungsten trioxide (mWO3) is introduced as interesting anode electrode for LIBs due to its good structure for intercalation and de-intercalation of lithium ions, high abundance and various oxidation state of tungsten and etc. In this study, we prepare and investigate the effect of various amounts of nickel dopant on characteristics and electrochemical properties of the mWO3 as the anode electrode in a rechargeable LIB. The experimental investigations confirm that the number of nickel atoms has a remarkable effect on controlling spherical particle diameter, crystallite size, and... 

Today, Li-ion batteries (LIBs) are the most common rechargeable batteries used in electronic devices. SnO2 with theoretical specific capacity of 782 mAh/g is among the best anode materials for LIBs. In this report, Threedimensional SnO2 nanowires (NWs) on carbon nanotube (CNT) thin film (SnO2 / CNT) is fabricated using a combination of vacuum filtration and thermal evaporation techniques. The resulting 3D heterostructure SnO2/CNT was characterized by X-ray diffraction, transmission electron microscopy (TEM) and scanning electron microscopy (SEM). This fabricated SnO2/CNT electrode has been tested as a flexible and binderfree anode for LIB, which exhibits high initial discharge/charge... 

According to the importance of polyanion cathode materials in intercalation batteries, they may play a significant role in energy-storage systems. Here, evaluations of LiMBO3 and NaMBO3 (M = Mn, Fe, Co, Ni) as cathode materials of Li-ion and Na-ion batteries, respectively, are performed in the density functional theory (DFT) framework. The structural properties, structural stability after deintercalation, cell voltage, electrical conductivity, and rate capability of the cathodes are assessed. As a result, Li compounds have more structural stability and energy density than Na compounds in the C2/c frame structure. Cell voltage is increased by increasing the atomic number of the transition... 

Lithium ion batteries as one of the most important energy storage equipments, have several challenges including capacity drop as number of cycles increases. Cathode particle coating is an effective approach in improvement of electrochemical performance of the batteries. In this study, TiO2-Ag coating was used to improve NCM cathode performance. The microstructure and crystal structure properties of coated NCMs were evaluated by the FE-SEM and XRD. Electrochemical behavior of the batteries was investigated by cycling performance analysis and EIS. TiO2 coating was deposited as a uniform layer and Ag coating was precipitated as dispersed nanoparticles. The results shows that using of TiO2-Ag... 

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 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 Li-ion batteries, application of active materials can enhance the kinetics of the charge-discharge process, reduce the costs and improve the safety of the system. In this work, the effect of nickel content and lithium excess in Li1+x (Ni0.4-xMn0.5Co0.1) O2 compounds on the electrochemical performance of the lithium-ion battery cathode have been studies. For this purpose, three compounds of NMC in the stoichiometric state were synthesized via co-precipitation as the cathode active material. XRF and EDS analyses indicate that precursors and oxide compounds are well synthesized. The final compound of synthesized cathodes was obtained by ICP analysis. XRD results also suggest 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... 

Here, we report 3D hierarchical SnO2 nanowire (NW) core-amorphous silicon shell on free-standing carbon nanotube paper (SnO2@a-Si/CNT paper) as an effective anode for flexible lithium-ion battery (LIB) application. This binder-free electrode exhibits a high initial discharge capacity of 3020 mAh g-1 with a large reversible charge capacity of 1250 mAh g-1 at a current density of 250 mA g-1. Compared to other SnO2 NW or its core-shell nanostructured anodes, the fabricated SnO2@a-Si/CNT structure demonstrates an outstanding performance with high mass loading (∼5.9 mg cm-2), high areal capacity (∼5.2 mAh cm-2), and large volumetric capacity (∼1750 mAh cm-3) after 25 cycles. Due to the...