Browsing by Author "Vijayan, Ariya K."

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    Electrochemical performance investigation of different shaped transition metal diselenide materials based symmetric supercapacitor with theoretical investigation
    (Elsevier B.V., 2023-10-11T00:00:00) Tanwar, Shweta; Singh, Nirbhay; Vijayan, Ariya K.; Sharma, A.L.
    Transition metal diselenide-based electrodes for hybrid symmetric supercapacitors appear as trending materials. Thereby in this paper, we report the preparation of different-shaped transition metal diselenides using a single-step hydrothermal route. The impact of the different morphology of the prepared transition metal diselenide material has been studied on their electrochemical performance. The nanoflower-shaped MoSe2 material was observed to deliver the highest electrochemical result than nanoneedles and nanospheres shape of CoSe2 and NiSe2 material respectively. The highest specific capacitance delivered by the MoSe2 material-based symmetric supercapacitor was 154 F g?1 at 10 mV s?1. It also exhibits a maximum energy density of 17 Wh kg?1 with 1267 W kg?1 power density. Further, the MoSe2-based symmetric supercapacitor has been utilized to burn different colors of light-emitting diodes along with a panel of 26 LEDs of red color. To make the working of the symmetric supercapacitor (MoSe2-based) easier to understand for the readers we have proposed a mechanism of charge storage associated with it. Additionally, the experimental finding has been supported by investigating the structural and electronic properties of MoSe2, CoSe2, and NiSe2 via density functional theory calculation. � 2023
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    Theoretical investigation of quantum capacitance of Co-doped ?-MnO2 for supercapacitor applications using density functional theory
    (Royal Society of Chemistry, 2023-09-07T00:00:00) Vijayan, Ariya K.; Sreehari, M.S.; Kour, Simran; Dastider, Saptarshi Ghosh; Mondal, Krishnakanta; Sharma, A.L.
    The rapid depletion of fossil fuels and ever-growing energy demand have led to a search for renewable clean energy sources. The storage of renewable energy calls for immediate attention to the fabrication of efficient energy storage devices like supercapacitors (SCs). As an electrode material for SCs, MnO2 has gained wide research interest because of its high theoretical capacitance, variable oxidation state, vast abundance, and low cost. However, the low electric conductivity of MnO2 limits its practical application. The conductivity of MnO2 can be enhanced by tuning the electronic states through substitution doping with cobalt. In the present work, first principles analysis based on density functional theory (DFT) has been used to examine the quantum capacitance (CQC) and surface charge (Q) of Co-doped MnO2. Doping enhanced the structural stability, electrical conductivity, potential window, and quantum capacitance of ?-MnO2. The shortened band gap and localized states near the Fermi level improve the CQC of ?-MnO2. For the narrow potential range (?0.4 to 0.4 V), the CQC is observed to increase with doping concentration. The highest CQC value at +0.4 V is observed to be 2412.59 ?F cm?2 for Mn6Co2O16 (25% doping), five times higher than that of pristine MnO2 (471.18 ?F cm?2). Mn6Co2O16 also exhibits better CQC and �Q� at higher positive bias. Hence, it can be used as an anode material for asymmetric supercapacitors. All these results suggest better capacitive performance of Co-doped ?-MnO2 for aqueous SCs and as an anode material for asymmetric supercapacitors. � 2023 The Royal Society of Chemistry.