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Coupled Cluster Green's Functions for Periodic Systems: Ab-inito Computation and Applications

Citation

Yu, Jason M. (2019) Coupled Cluster Green's Functions for Periodic Systems: Ab-inito Computation and Applications. Master's thesis, California Institute of Technology. doi:10.7907/0P9H-ZQ15. https://resolver.caltech.edu/CaltechTHESIS:07202019-210018604

Abstract

The Coupled Cluster Green’s function method is expanded to periodic systems and preliminary results of the spectral function for diamond and graphene are shown. Future improvements and potential applications are discussed.

Item Type:Thesis (Master's thesis)
Subject Keywords:Electronic Structure; Coupled Cluster; Green's Functions; Periodic Boundary Conditions, Ab initio
Degree Grantor:California Institute of Technology
Division:Chemistry and Chemical Engineering
Major Option:Chemistry
Thesis Availability:Public (worldwide access)
Research Advisor(s):
  • Chan, Garnet K.
Thesis Committee:
  • Stoltz, Brian M. (chair)
  • Chan, Garnet K.
Defense Date:14 June 2019
Non-Caltech Author Email:jasonmyu1 (AT) gmail.com
Record Number:CaltechTHESIS:07202019-210018604
Persistent URL:https://resolver.caltech.edu/CaltechTHESIS:07202019-210018604
DOI:10.7907/0P9H-ZQ15
ORCID:
AuthorORCID
Yu, Jason M.0000-0002-2270-6798
Default Usage Policy:No commercial reproduction, distribution, display or performance rights in this work are provided.
ID Code:11745
Collection:CaltechTHESIS
Deposited By: Jason Yu
Deposited On:01 Aug 2019 23:11
Last Modified:18 Dec 2020 00:35

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