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

dc.contributor.author	Sarmah, Amrit
dc.date.accessioned	2022-05-14T05:02:57Z
dc.date.available	2022-05-14T05:02:57Z
dc.date.issued	2015-08
dc.identifier.uri	http://dspace.bits-pilani.ac.in:8080/xmlui/handle/123456789/4856
dc.description	Supervisor: Ram Kinkar Roy	en_US
dc.language.iso	en	en_US
dc.publisher	BITS, Pilani	en_US
dc.subject	Chemistry	en_US
dc.subject	Chemical Reaction	en_US
dc.subject	Density Functional Theory	en_US
dc.subject	Thermodynamics	en_US
dc.title	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	en_US
dc.type	Thesis	en_US