Rational design of low-dimensional catalysts using first principles methods

Transition metal carbides and nitrides are promising catalytic supports because of their well-defined and intrinsically tunable structures. Such supports span a vast space of materials (~103) and exhibit tunable dimensionality (2D MXenes or 3D structures), surface chemistry (unary or binary combinat...

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Bibliographic Details
Main Author: Rekhi, Lavie
Other Authors: Tej Salil Choksi
Format: Thesis-Doctor of Philosophy
Language:English
Published: Nanyang Technological University 2024
Subjects:
Online Access:https://hdl.handle.net/10356/178345