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Anita Gemmy Francis
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Computational Investigations of Topological and Magnetic Phases in a Few Chalcogenides and Rare-Earth Oxides
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Ph.D.
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Supriti Dutta
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Computational Studies on the Photo-Electrocatalytic Activity and Selectivity in Renewable Energy Conversion Processes
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Ph.D.
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Bidhan Chandra Garain
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Computational Perspectives on Triplet Exciton Harvesting: A Combined Ab Initio and Machine Learning Investigation
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Ph.D.
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Madhulika Mazumder
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Computational Perspectives Towards Designing Intercalation Cathode Frameworks for Sodium Ion Batteries
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Ph.D.
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Pallavi Sarkar
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Computational Studies on the Mechanism of Main-Group Catalysed Reduction Reaction
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Ph.D.
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Raju Kumar Biswas
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Computational Study on the Role of Charge and Phonon Transport in Electronic and Thermoelectric Applications in a Few Chalcogenides
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Ph.D.
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Neha Bothra
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Computational Studies of a few Heterogeneous and Homogeneous Electrocatalytic Conversion Processes for Renewable Energy
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Ph.D.
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Abhiroop Lahiri
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Computational Study of Magnetic, Magnetoelectric and Electronic Properties of Some Quantum Many-Body Systems
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Ph.D.
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Brijesh
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Molecular Dynamics and Machine Learning Studies on Bacteria-Drug Interaction and SARSCOV-2 Binding Affinity
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Ph.D.
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Madhulika Mazumdar
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Optoelectronic and Electrochemical Phenomena in Materials at Different Dimensions: A Computational Study
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M.S. in Chemical Science
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Shubhajit Das
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Computational Studies on the Mechanisms of Hydrogen Activation and Catalytic Hydrogenation by Cooperative Lewis Pairs
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Ph.D.
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Abhiroop Lahiri
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Computation of Non-linear Magnetoelectric Coefficients for Low Dimensional Systems and Development of a few Quantum Many Body Methods
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M.S. in Materials Science
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Prakash Parida
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Electronic Structure and Transport Behaviours in some Low-dimensional systems: Quantum Many-body and ab-initio studies
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Ph.D.
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Arun Kumar Manna
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Exploring Electronic Structure of a few Biomolecules and Graphitic Materials
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Ph.D.
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S.R.K. Chaitanya Sharma Y
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Computational Studies on Electronic Structure and Optical Properties of a Few Low-Dimensional Systems
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M.S. in Materials Science
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Arkamita Bandyopadhyay
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Electronic, Optical and Charge Transfer Properties of A Few Quantum Dots and MoS2 Layer: A Density Functional Theory Study
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M.S. in Chemical Science
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Ms Pallavi Bothra
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Trends in Activity and Selectivity in Catalytic Energy Conversion Processes: A First Principles Study
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Ph.D.
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Wasim Raja Mondal
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First Principles Study of a few Pnictide Superconductors and Surface States of a Topological Insulator
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M.S. (Engg.)
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S R K Chaitanya Sharma Yamijala
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Computational Investigations of a Few Low-dimensional Systems: Effects of Size, Defects and Molecular Adsorption’
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Ph.D.
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Ershaad Ahmed Basheer
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Understanding the Electronic Structure of Organometallic Sandwich Complexes and Graphene based Nanomaterials
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M.S. (Engg.)
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Dibyajyoti Ghosh
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Aromaticity, Transport and Spin Filter Properties of a few Molecular Systems
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M.S. in Materials Science
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Dibyajyoti Ghosh
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Electronic and Transport Characteristics of Low-dimensional Materials: Effect of Structural Imperfection, Metal Inclusion and Spin-crossover
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Ph.D.
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Ayan Datta
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Quantum Chemical Investigation of Linear and Nonlinear Polarizabilities in Organic Molecular Aggregates and Inorganic Clusters
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M.S. in Chemical Science
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Ayan Datta
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Theoretical investigations of optical polarizations in chromophoric aggregates and nonlocal charge distributions in clusters
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Ph.D.
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Lakshmi S
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Theoretical modeling of electron transport through molecular bridges
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Ph.D.
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Debabrata Parihari
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Numerical Studies of low energy behaviour of a few spin ladders and magnetic field effects in heavy fermions
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Ph.D.
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Sairam Swaroop Mallajosyula
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Theoretical Investigations of Electronic Structure and Charge Transfer Properties of DNA and Modified DNA
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Ph.D.
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Shrinwantu Pal
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Theoretical Investigations on Cooperative Phenomena in a few Molecular and Macromolecular Systems
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M.S. in Chemical Science
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Sudipta Dutta
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Interaction Driven Electronic Properties of Some Low-Dimensional Systems
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Ph.D.
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Sasmita Mohakud
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Theoretical Modeling of Some Low Dimensional Quantum Spin Systems and Charge Transport in a Few Organic Materials
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Ph.D.
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Swastika Banerjee
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Role of Surface Chemistry to Regulate the Anodic Behaviour, Charge Transport and Reactivity: A Computational Study
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Ph.D.
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Bradraj Pandey
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Phase Transitions in a few Low Dimensional Optical Lattices: A Quantum Many Body Study
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Ph.D.
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Arkamita Bandyopadhyay
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‘Role of Structural Modifications in Low-Dimensional Systems for Opto-Electronics and Molecular Recognition: A Computational Study’
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Ph.D.
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Pralok Kumar Samata
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Theoretical Investigations of Electronic Structure and Opto-electronic Properties of a few DNA and Modified DNA Systems
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Ph.D.
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Soumya Satpathi
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Theoretical Studies of a Few Quantum Many-Body Systems
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M.S. in Materials Science
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Utkarsh Singh
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Triple Exciton Harvesting Pathways in Organic Systems
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M.S. in Materials Science
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Shenoy Pralhad Shankar
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Computational Modeling of Homogeneous Catalytic Reactions and Development of Microkinetic Modeling
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M.S. in Chemical Science
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