Browsing Inorganic and Physical Chemistry (IPC) by Title
Now showing items 78-97 of 303
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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 ... -
Excited State Intramolecular Charge Transfer: Ultrafast Electronic and Vibrational Spectroscopic Study
This thesis incorporates the understanding of the ultrafast excited state photoinduced intramolecular charge transfer (ICT) process in liquid phase. The molecular systems are studied by employing Ultrafast Raman Loss ... -
Exploring Hyperbranched Polymers as Multifunctional Scaffolds
Hyperbranched polymers (HBPs) are highly branched macromolecules that exhibit excellent solubility, low melt viscosity, and they possess a multitude of modifiable peripheral functional groups.1 Unlike their structurally ... -
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 ... -
First Hyperpolarizability (β) of Organic and Inorganic Compounds : Keto-Enol Tautomerism and Halogen Effect
(2018-05-09)The work presented in this thesis has broadly established a few findings about the structure¬hyperpolarizability relation in molecular compounds: First, by measuring βHRS of an organic keto-enol tautomer, benzoylacetanilide ... -
Functional Derivatives Of MEHPPV Using The Dithiocarbamate Precursor Route
(2009-04-02)Emissive conjugated polymers, namely PPV, PPP, polyfluorenes, etc, have gained considerable attention in recent times, specifically because of their potential application in the fields of PLED’s, displays, FET’s and ... -
Functional Hyperbranched Polyethers Via Melt-Transetherification Polymerization
(2010-04-12)Dendrimers are highly branched macromolecules which are prepared by a stepwise procedure. The presence of a well-defined core, discrete generations and a large number of terminal groups in dendrimers make them structurally ... -
Functionalized Hyperbranched Polymers And Nonionenes
(2016-10-20)In 1980’s a new class of material named as dendrimer became popular both in the field of polymer science and engineering. Dendrimer is an example of symmetric, highly branched three dimensional globular nano-object. It ... -
Functionalized Layered Double Hydroxides and Gold Nanorods
(2018-07-28)The reversible and topotactic insertion of guest species within layered host lattices, known as intercalation is a widely studied phenomena. The Layered Double Hydroxides (LDHs) or Anionic Alloys are important class of ... -
Functionalized Nanostructures : Iron Oxide Nanocrystals and Exfoliated Inorganic Nanosheets
(2018-05-01)This thesis consists of two parts. The first part deals with the magnetic properties of Fe3O4 nanocrystals and their possible application in water remediation. The second part is on the delamination of layered materials ... -
Gas Phase Infrared Spectra Of Some PAHs And Diols : Experiment And Theory
(2011-06-30)In this thesis, I report the gas phase infrared spectra of some polycyclic aromatic hydrocarbons (PAHs) namely 1, 5-, 1, 6-, and 2, 6-dimethyl naphthalenes (DMNs); 2, 4-, 2, 6-, 2, 7-, and 2,8-dimethyl quinolines (DMQs); ... -
Gas Phase Infrared Spectroscopy of Large Aromatic Molecules : Fermi Resonance in the C-H Stretching Region
(2018-07-19)In this thesis, I have investigated gas phase infrared spectroscopy of environmentally as well as astrophysical important large organic molecules such as naphthalene, methy-lated naphthalene, fluorine, methyalted fluorine ... -
Generalized Random Walk Models Of Chain Statistics
(2012-12-05) -
Graphite Oxide And Graphite Oxide-Based Composites : Physicochemical And Electrochemical Studies
(2013-07-19)One of the major directions of research in the area of materials science is to impart multifunctionalities to materials. Carbon stands on the top of the list to provide various multifunctional materials. It exists in all ... -
Halogen Bonding in the Structure and Biomimetic Dehalogenation of Thyroid Hormones and Halogenated Nucleosides
(2018-06-18)Thyroid hormones, which are secreted by the thyroid gland, are one of the most important halogenated compounds in the body. Thyroid hormones control almost every processes in the body including growth, body temperature, ... -
High Capacity Porous Electrode Materials of Li-ion Batteries
(2017-12-12)Lithium-ion battery is attractive for various applications because of its high energy density. The performance of Li-ion battery is influenced by several properties of the electrode materials such as particle size, surface ... -
Highly Reactive Ru(II) Complexes Stabilized by Agostic Interaction/N2 Binding: Small Molecule Binding and Utility in Hydrogenation Catalysis
Binding and activation of chemically inert and strong sigma H−X bonds (X = H, B, Si, C) in small molecules such as H2, H3B.NR3, HSiR3, and CH4 have been the subject of intense research interest. The binding of a small ...