Faculty Publications
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Item Improving the: ZT of SnTe using electronic structure engineering: Unusual behavior of Bi dopant in the presence of Pb as a co-dopant(Royal Society of Chemistry, 2021) Shenoy, U.S.; Bhat, D.K.Electronic structure engineering of SnTe by doping various elements to improve its figure of merit has been the most promising approach recently sought after. Pb doped in SnTe is well known to decrease the thermal conductivity but fails to beneficially tune its electronic properties. Herein, we co-dope Bi in SnTe doped with Pb, to improve the power factor of the material. Bi in the presence of Pb exhibits unusual features not shown in the case of Bi doped SnTe. The synergistic action leads to an increase in the band gap and valence band convergence. Bi also introduces resonance states just below the conduction band edge and causes conduction band convergence. An enhanced power factor due to modification of the electronic structure combined with reduced thermal conductivity translates into an enhanced figure of merit of up to ?1.58 at 800 K as predicted using Boltzmann transport calculations, making it a potential thermoelectric material worthy of further study. This journal is © The Royal Society of Chemistry.Item A case of perfect convergence of light and heavy hole valence bands in SnTe: the role of Ge and Zn co-dopants(Royal Society of Chemistry, 2022) Shenoy, U.S.; D, G.K.; Bhat, D.K.A dual step approach of decreasing the thermal conductivity and improving the power factor by using two different dopants has shown great promise in the development of high performance thermoelectrics. In this work, we dope Ge, which is well known to decrease the thermal conductivity of SnTe. Later, to this, we co-dope Zn to simultaneously improve the power factor. Zn, in the presence of Ge, introduces resonance levels, thus distorting the density of states near the Fermi level, improving the room temperature performance. In addition, it is also able to increase the band gap, thus preventing bipolar diffusion at high temperatures. The unique feature exhibited is the perfect convergence of light and heavy hole valence sub-bands achieved for the first time in SnTe promising a high performance throughout the temperature range. The transport property calculations reveal that in addition to p-type, it can also act as an outstanding n-type material by tuning its chemical potential, making it worth studying experimentally. © 2022 RSC.Item Formulation and optimization of Ni-MOF/CuSe nanocomposite ink for high-performance flexible microsupercapacitor(Elsevier Ltd, 2024) Saquib, M.; Muthu, M.; Nayak, R.; Prakash, A.; Sudhakar, Y.N.; SenthilKumar, S.; Bhat, D.K.The growth of flexible and wearable electronics drives progress in printed, flexible micro-supercapacitors for energy storage. This study fabricates flexible and foldable micro-supercapacitors using a nanocomposite of Ni-based Metal-Organic Framework (Ni-MOF) and copper selenide (CuSe). The conductive ink, blending Ni-MOF and CuSe, ensures thorough mixing for screen-printing. The resulting devices exhibit impressive electrochemical performance, with the NC-5 FAS device showing high areal capacitance, promising energy density and (3.65 mWhcm?2 and power density (73.8 mWcm?2). Integration into a 3D enclosure configuration enhances performance, with improved capacitance, energy density (47.08 mWhcm?2) and power density and outstanding power density (985.8 mWcm?2), maintaining capacitance retention of the 93.9 % and with highly robust mechanical durability during flexibility tests. This study highlights tailored nanocomposite's potential to revolutionize flexible and foldable energy storage, advancing high-performance, portable electronics. © 2024Item Enhanced flexibility and performance of interdigitated microsupercapacitors through in-situ rGO growth in NiCuSe nanocomposite conductive ink(Elsevier Ltd, 2025) Saquib, M.; Nayak, R.; Muthu, M.; Bhat, D.K.; Rout, C.S.Microsupercapacitors (MSCs) are promising alternative power sources capable of meeting the growing demand for wearable and on-chip electronics due to their compact size, lightweight nature, exceptional charge-discharge rates, high power densities, and superior flexibility. However, a major challenge in current MSCs development lies in their limited energy density, high-cost, and time-intensive fabrication processes. This study focuses on fabricating flexible interdigitated printed MSCs using in-situ growth of reduced graphene oxide within nickel-copper selenide nanocomposite inks via screen printing. The eco-friendly ink formulation incorporates ethyl cellulose, diacetone alcohol, and a non-ionic surfactant to optimize printability, viscosity, and post-drying efficacy. The MSCs achieved a high areal capacitance of 756.3 mFcm?2 at 5 mVs?1, with energy densities of 84.4 µWcm?2 (symmetric) and 151.2 µWhcm?2 (asymmetric), and corresponding power densities of 406 mW cm?² and 1210 mW cm?². The printed devices retained 94.2 % of their capacitance on PET (Polyethylene terephthalate) substrates and exhibited excellent mechanical stability under bending, making them ideal for wearable electronics and flexible IoT applications. These results highlight the potential of the fabricated screen-printed MSCs, leveraging the optimized electrode material, as a high-performance and eco-friendly energy storage technology for next-generation flexible electronics. © 2025 The Authors