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    Computational Studies of Hydrophobic Force Law, Dynamics in Model Asymmetric Binary Mixtures, and Contribution to One and Two Dimensional Infrared Spectroscopy 

    Samanta, Tuhin
    Depending on the system and phenomena of interest, the thesis has been partitioned into three major parts. The first part is on the theoretical infrared spectroscopic studies and vibrational phase relaxation of supercritical ...

    Protein-Nanomaterial Interactions: Structural And Dynamic Aspects 

    Malik, Shahid A
    Owing to their unique properties, the noble metallic nanoparticles and graphenic nanomaterials find their applications in diverse fields of science. Particularly in the field of biomedicine, nanomaterials are being used ...

    Studies on Quinoidal Diketopyrrolopyrrole Derivatives and their Applications 

    Sharma, Shikha
    Quinoidal π-conjugated molecules have endowed significant attention over the years especially due to inherent high electron affinity and amphiprotic redox behavior, establishing their application as versatile active material ...

    Mechanistic Understanding of Organic Solar Cells: A Detailed Investigation on Role of Förster Resonance Energy Transfer, Dielectric Constant and Exciton Dynamics 

    Mohapatra, Aiswarya Abhisek
    Organic solar cells (OSC) have been emerging as promising energy harvesting technology because of their low-cost fabrication, semitransparency, solution processability and ability to be produced in large scale using ...

    Development of Novel NMR Methodology and Investigation of Challenging Chemical Problems 

    Arya, Neeru
    The thesis is entitled as "Development of Novel NMR Methodology and Investigation of Challenging Chemical Problems ". The research work reported in this thesis is mainly carried out in two directions. The initial focus ...

    Modeling Magnetic Anisotropy in Single Chain Magnets 

    Haldar, Sumit
    This thesis embodies work on modeling magnetic anisotropy in molecular magnets. Understanding the factors that govern the magnitude of anisotropy in these materials is crucial for tailoring molecules that can be used in ...

    Investigating the Role of Domain Swapping in Aggregation of Globular Proteins 

    Mondal, Balaka
    The broad objective of this thesis involves computationally modeling protein aggregation with special emphasis on the role of cosolvents and misfolded states. Chapter 1 contrasts the effect of biologically relevant co-solvents ...

    Transport, Relaxation and Line shape in Quantum Dissipative Systems with Applications to Photosynthesis and Conjugated Polymers 

    Dutta, Rajesh
    The thesis entitled as “Transport, Relaxation and Line shape in Quantum Dissipative Systems with Applications to Photosynthesis and Conjugated Polymers” has been divided into five major parts and ten chapters. In Part ...

    Structure, Thermodynamics and Dynamics in Complex Systems: From Stability of Biomolecules to Phase Transitions in Polymorphic Ice 

    Mukherjee, Saumyak
    This thesis deals with the understanding of the structure, dynamics and thermodynamics in complex systems (proteins, hydration layers, DNA, ice polymorphs) by employing computer simulations, theoretical analysis, and in ...

    Synthesis, Structure, Optical, SHG and Multiferroic Investigations on Compounds derived from Mineral Structures 

    Bhim, Anupam
    The present thesis provides a systematic investigation of compounds derived from different mineral structures. The compounds were explored for their optical, visible light-activated photocatalysis, Second Harmonic Generation ...
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    AuthorAnumol, S (1)Arya, Neeru (1)Aswathy, M N (1)Bhardwaj, Ravindra Kumar (1)Bhim, Anupam (1)Chakraborty, Shaunak (1)Dan, Tinku (1)Das, Sambunath (1)Dhanishta, Poshetti (1)Dutta, Ajana (1)... View MoreSubject
    NATURAL SCIENCES (44)
    NMR Spectroscopy (3)Computer simulation (2)Doping (2)Molecular Dynamics Simulation (2)Nanomaterials (2)Quantum Dots (2)Soft condensed matter (2)Water (2)Absorption Spectroscopy (1)... View MoreHas File(s)Yes (44)

    etd@IISc is a joint service of SERC & J R D Tata Memorial (JRDTML) Library || Powered by DSpace software || DuraSpace
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