Formal and Conceptual Development of Density Functional Theory (DFT) Based Reactivity Descriptors and Their Applications to Understand Kinetic and Thermodynamic Aspects of a Chemical Reaction

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dc.contributor.authorSarmah, Amrit
dc.date.accessioned2022-05-14T05:02:57Z
dc.date.available2022-05-14T05:02:57Z
dc.date.issued2015-08
dc.descriptionSupervisor: Ram Kinkar Royen_US
dc.identifier.urihttp://dspace.bits-pilani.ac.in:8080/xmlui/handle/123456789/4856
dc.language.isoenen_US
dc.publisherBITS, Pilanien_US
dc.subjectChemistryen_US
dc.subjectChemical Reactionen_US
dc.subjectDensity Functional Theoryen_US
dc.subjectThermodynamicsen_US
dc.titleFormal and Conceptual Development of Density Functional Theory (DFT) Based Reactivity Descriptors and Their Applications to Understand Kinetic and Thermodynamic Aspects of a Chemical Reactionen_US
dc.typeThesisen_US

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