Browsing Division of Chemical Sciences by Title
Now showing items 209-228 of 824
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Engineered Catalytic Metal—Metal-Oxide Nano-heterostructures for CO Oxidation
Owing to its interesting chemistry and toxic nature, catalytic oxidation of CO is of both fundamental and practical interest. Two applications, viz. CO conversion in the catalytic converters and pre-treatment of CO-rich ... -
Engineered Nanomaterials: Array-based Sensing of Biological and Chemical Analytes
Array-based sensing, also known as chemical nose/tongue analysis, offers an alternative platform for simultaneous differentiation of a wide range of analytes using a fixed number of cross-reactive receptors. The sensor ... -
Epitaxial Nonpolar III-Nitrides by Plasma-Assisted Molecular Beam Epitaxy
(2018-08-09)The popularity of III-nitride materials has taken up the semiconductor industry to newer applications because of their remarkable properties. In addition to having a direct and wide band gap of 3.4 eV, a very fascinating ... -
Epitaxial Perovskite Superlattices For Voltage Tunable Device Applications
(2013-10-03)Perovskite based artificial superlattices has recently been extensively investigated due to the immense promise in various device applications. The major applications include non-volatile random access memories, microwave ... -
Ethylene Glycol in the Liquid State: Structure, Conformation and Dynamics - A Study Using Ab Initio Molecular Dynamics Simulations
Ethylene glycol (EG) is an important organic molecule with unique properties and a wide range of applications. The EG molecule shares a structural motif with many biomolecules and serves as a part of the training set for ... -
Evolution of New Lipids and Molecular Gelators : Syntheses, Aggregation Properties and Applications
(2018-05-14)The thesis entitled “Evolution of New Lipids and Molecular Gelators: Syntheses, Aggregation Properties and Applications” elucidates the design, synthesis, aggregation properties and application of new lipids based on ... -
Excitation Energy Transfer In Donor-Acceptor Systems Involving Metal Nanoparticles, And In Conjugated Polymers
(2013-02-19)This thesis consists of two parts and nine chapters. The first part (Part I) presents theoretical studies on non-radiative mode of excitation energy transfer (EET) in donor-acceptor (D-A) systems involving metal nanoparticles. ... -
Experimental And Theoretical Studies Of Strongly Correlated Multiferroic Oxides
(2011-05-23)This thesis presents the synthesis and investigations of physical and chemical properties of multiferroic materials experimentally as well as theoretically. Multiferroics are materials in which at least two of the three ... -
Exploration of 1,9-Pyrazoloanthrones as a Copious Reserve for Multifarious Chemical and Biological Applications
(2018-01-07)Pyrazoloanthrone and its analogues form the central core of the thesis and the work is focused on the evaluation of chemical and biological applications of pyrazoloanthrones. Selective and sensitive detection of biologically, ... -
Exploration of exfoliation, functionalization and properties of MXenes via first-principles and machine learning
The monolayers of early transition metal carbides and carbonitrides named MXenes are exfoliated from the corresponding bulk MAX phases (Mn+1AXn, M = early transition metal, A = group IIIA or IVA element and X = carbon ... -
Exploration of Ti-based Anodes for Rechargeable Alkali-ion Batteries And Hybrid-ion Capacitors
From 600 B.C. till 1700 A.D., electricity remained the least understood form of energy and was considered "Magical." In the 18th century A.D., the electricity that mysteriously struck Franklin as he arduously flew a kite ... -
Exploring Diverse Facets of Small Molecules by NMR Spectroscopy
(2017-12-07)The thesis entitled “Exploring Diverse Facets of Small Molecules by NMR Spectroscopy” consists of six chapters. The main theme of the thesis is to exploit one and two dimensional NMR methodologies for understanding the ... -
Exploring Intermolecular Space By Charge Density Analysis In Molecular Crystals
(2013-06-21)The thesis entitled “Exploring Intermolecular Space by Charge Density Analysis in Molecular Crystals” consists of five chapters. A short introductory note highlights the importance of intermolecular interactions and presents ... -
Exploring New Designs of Amphiphilic Graft Copolymers and Forays into 2D Polymers
Amphiphilic polymers, wherein two or more immiscible polymeric segments are connected covalently, form an interesting class of macromolecules that can self-assemble in block selective solvents as well as in bulk, to exhibit ... -
Exploring Structure and Reactions : Computational Studies on Three-Membered Rings, Metal-Boron Multiple Bonds and Biradical Reactions
(2018-04-06)The utility of computational study lies not only in rationalizing a chemical phenomenon but also in its predictive value. Broadly, the scope of my research work includes understanding of the structure and bonding of molecules ... -
Exploring Topological Phases of Matter using Density Functional Theory and Machine Learning Approaches
Topological phases of matter such as topological insulator (TI), quantum anomalous Hall insulator (QAHI), nodal line semimetal (NLSM), and triple point metal (TPM) can be realized by manipulating the spin-orbit coupling ... -
Exploring Transition Metal Oxides Towards Development of New Functional Materials : Lithium-ion Battery Cathodes, Inorganic Pigments And Frustrated Magnetic Perovskite Oxides
(2017-10-11)Transition metals (TMs) are ‘elements whose atoms have partially filled d-shell, or which can give rise to cations with an incomplete d-shell’. In TMs, the d-shell overlaps with next higher s-shell. Most of the TMs exhibit ...