DFT simulation of NaFeSnO4 structure, electronic and electrochemical properties validated by experimental results von Mandal, Biswajit, Chakrabarti, Shamik, Thakur, Awalendra K.

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Density functional theory and experimental study of multi-step lithiation in SnS2 anode von Chakrabarti, Shamik, Babu, Puli Sunny, Thakur, A. K.

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DFT study of Li2NiTiO4 and vanadium-doped Li2NiTiO4 von Chakrabarti, Shamik, Biswas, K.

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Tuning of Band Gap of Cathode Li2NiPO4F by Replacing P to Nb and Forming Li2NiNbO4F for Application as 5 V Cathode in Lithium Ion Battery: A Density Functional Theory Study von Chakrabarti, Shamik, Thakur, A. K.

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Tuning of Band Gap of Cathode Li 2 NiPO 4 F by Replacing P to Nb and Forming Li 2 NiNbO 4 F for Application as 5 V Cathode in Lithium Ion Battery: A Density Functional Theory Study von Chakrabarti, Shamik, Thakur, A. K.

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Density Functional Theory Study of Lithiation and Sodiation in Sb2S3 and Sb2Se3 Anode Accompanying by S/Se Redox von Chakrabarti, Shamik, Singh, Arvind, Thakur, A. K.

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Density Functional Theory Study of Lithiation and Sodiation in Sb 2 S 3 and Sb 2 Se 3 Anode Accompanying by S/Se Redox von Chakrabarti, Shamik, Singh, Arvind, Thakur, A. K.

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Prediction of feasibility of Li and Fe doped natural olivine Mg2SiO4 for Li ion battery applications using Density Functional Theory von Chakrabarti, Shamik, Biswas, K.

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Density functional theory analysis of Na4Mn4Ti5O18 for sodium ion battery electrode von Mandal, Biswajit, Chakrabarti, Shamik, Thakur, Awalendra K.

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Effect of carbon coating on improved electrical and electrochemical performance of Li 3 Co 2 SbO 6 von Singh, Arvind, Chakrabarti, Shamik, Nair, Manjula G, Thakur, A K

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Effect on de-hydrogenation efficiency on doping of rare earth elements (Pr, Nd, Gd, Dy) in MgH2 – A density functional theory study von Chakrabarti, Shamik, Biswas, K.

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Controlled single step synthesis, structural and electrode response of honeycomb layered Li 3 Co 2 SbO 6 von Singh, Arvind, Chakrabarti, Shamik, Nair, Manjula G, Thakur, A K

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Investigation on structural, electronic and magnetic properties of Co2FeGe Heusler alloy: Experiment and theory von Mitra, Srimanta, Ahmad, Aquil, Chakrabarti, Shamik, Biswas, Sajib, Das, Amal K.

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DFT study of Mg2TiO4 and Ni doped Mg1.5Ni0.5TiO4 as electrode material for Mg ion battery application von Chakrabarti, Shamik, Biswas, K.

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DFT study of Mg.sub.2TiO.sub.4 and Ni doped Mg.sub.1.5Ni.sub.0.5TiO.sub.4 as electrode material for Mg ion battery application von Chakrabarti, Shamik, Biswas, K

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Study of structural, electronic, magnetic and vibrational properties of CoFeTiSi quaternary Heusler alloy von Mitra, Srimanta, Ahmad, Aquil, Chakrabarti, Shamik, Biswas, Sajib, Das, Amal Kumar

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Effect on specific capacity and de-hydrogenation efficiency in doped-MgH2 von Chakrabarti, Shamik, Biswas, K.

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Controlled single step synthesis, structural and electrode response of honeycomb layered Li3Co2SbO6 von Singh, Arvind, Chakrabarti, Shamik, Nair, Manjula G, Thakur, A K

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Effect of carbon coating on improved electrical and electrochemical performance of Li3Co2SbO6 von Singh, Arvind, Chakrabarti, Shamik, Nair, Manjula G, Thakur, A K

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Study of structural, electronic and magnetic properties of Ti doped Co2FeGe Heusler alloy: Co2Fe1−x Ti x Ge (x = 0, 0.5, and 0.75) von Mitra, Srimanta, Ahmad, Aquil, Chakrabarti, Shamik, Biswas, Sajib, Das, Amal Kumar

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