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potential energy surface
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1.
Ab initio Molecular Potential Energy Surface Constructionand Molecular Dynamics Simulation for Small Molecules
Student Name:
Xie, Zhen
Date Uploaded:
08/28/2018
Research Field:
Chemistry, Physical
Department or Specialty:
Chemistry
2.
Quantum Mechnical Study of Molecular Processes: From Gas Phase to Nano Phase
Student Name:
Wang, Zhi
Date Uploaded:
08/28/2018
Research Field:
Chemistry, Physical
Department or Specialty:
Chemistry
3.
Potential energy surface and applications to carbon dioxide-water, carbon dioxide clathrate hydrate and hydrated HCl system
Student Name:
Qingfeng Wang
Date Uploaded:
04/02/2018
Research Field:
Chemistry, Physical
Department or Specialty:
Chemistry
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Year
2008
2
Spring 2018
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School
Laney Graduate School
3
Department / Specialty
Chemistry
3
Degree
PhD
2
M.S.
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Submission Type
Dissertation
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Master's Thesis
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Research Field
Chemistry, Physical
3
Committee
Bowman, Joel M, Emory University
2
Kindt, James, Emory University
2
Bowman, Joel, Emory University
1
Evangelista, Francesco, Emory University
1
Heaven, Michael, Emory University
1
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Keyword
potential energy surface
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molecular dynamics
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QM/MD simulation
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SiC surface
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