Northwestern University

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Filtering by: Keyword Density Functional Theory Keyword Materials Design

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Expanding Functionalities in Heteroanionic Materials Through First-Principles Design

Description:

Advancements in the understanding and synthesis of transition metal compounds have allowed materials engineers to design functional materials with a range of properties, such as ferroelectricity, non-linear optical activity, colossal magnetoresistance, and superconductivity. Conventional routes to tune and design functional materials includes chemical cation substitution and heterostructuring of oxide thin...

Keyword:

Oxyfluoride, Materials Design, Functional Properties, and Density Functional Theory

Subject:

Materials Science

Creator:

Harada, Jaye Kimiko

Owner:

Scholarly Digital Publishing

Language:

en

Date Uploaded:

06/28/2021

Date Created:

2021-01-01

Resource Type:

Dissertation

Alternate Identifier:

etdadmin_upload_819002 and http://dissertations.umi.com/northwestern:15569