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Francesco A. Evangelista, Emory University
删除限定条件 Committee: Francesco A. Evangelista, Emory University
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Achieving quantum practicality via resource-efficient simulations of strongly correlat...
Theoretical Simulation of K-Edge X-Ray Absorption Spectra for Methane and Its Fluorina...
Develop multireference quantum embedding theories for chemical applications
Vibrational Dynamics of Hydrated Proton based on High-level Ab Initio Potential Energy...
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Year
Spring 2023
1
Summer 2019
1
Summer 2022
1
Summer 2023
1
School
Laney Graduate School
3
Emory College
1
Department
Chemistry
4
Degree
Ph.D.
3
B.S.
1
Submission Type
Dissertation
3
Honors Thesis
1
Research Field
Chemistry, Physical
4
Physics, Quantum
2
Physics, Molecular
1
Committee
Francesco A. Evangelista, Emory University
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4
James T. Kindt, Emory University
2
Joel M. Bowman, Emory University
2
Fang Liu, Emory University
1
Katherine M. Davis, Emory University
1
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Keyword
Core Excitation
1
Electronic structure
1
Embedding theory
1
GASSCF
1
Hydrated Proton, Potential Energy Surface, Vibrational Spectroscopy, Proton Transfer
1
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Keywords
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