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Exploration of aromaticity, through-space effect, and nature of CC bonds in chemistry using molecular electrostatic potential analysis

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dc.contributor.author Anjali Krishna P K
dc.date.accessioned 2025-02-19T04:29:15Z
dc.date.available 2025-02-19T04:29:15Z
dc.date.issued 2023-12
dc.identifier.citation PhD Thesis, ACSIR, xxxiv, 279p. en_US
dc.identifier.uri http://localhost:8080/xmlui/handle/123456789/4880
dc.description.abstract Molecular Electrostatic Potential (MESP) analysis is a powerful computational technique utilized in theoretical chemistry to explore the electrostatic properties of molecules. The thesis strives to elucidate the diverse applications of MESP analysis. Its objective is to highlight the capability of MESP in providing a unified perspective on the electrostatic properties of molecules and carbon-carbon (CC) bonds within the field of chemistry using Density Functional Theory (DFT). en_US
dc.language.iso en en_US
dc.publisher Chemical Sciences and Technology Division, National Institute for Interdisciplinary Science and Technology, Thiruvananthapuram under the supervision of Dr. C. H. Suresh en_US
dc.subject Aromaticity en_US
dc.subject CC Bonds en_US
dc.subject Potential Analysis en_US
dc.title Exploration of aromaticity, through-space effect, and nature of CC bonds in chemistry using molecular electrostatic potential analysis en_US
dc.type Thesis en_US


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