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Results for: Committee Member Adrianus C Van Duin Remove constraint Committee Member: Adrianus C Van Duin Year 2014 Remove constraint Year: 2014
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1. Application of Reactive Molecular Dynamics in Biomaterial Science and Computational Biology

Open Access
Author:
Golkaram, Mahdi
Title:
Application of Reactive Molecular Dynamics in Biomaterial Science and Computational Biology
Graduate Program:
Mechanical Engineering
Keywords:
File:
Committee Members:
  • Adrianus C Van Duin, Thesis Advisor/Co-Advisor

2. Cleanup of Biomass Gasification Effluent Using M-doped Ceria Catalysts

Open Access
Author:
Krcha, Matthew David
Title:
Cleanup of Biomass Gasification Effluent Using M-doped Ceria Catalysts
Graduate Program:
Chemical Engineering
Keywords:
File:
Committee Members:
  • Michael John Janik, Dissertation Advisor/Co-Advisor
  • Michael John Janik, Committee Chair/Co-Chair
  • Robert Martin Rioux Jr., Committee Member
  • Scott Thomas Milner, Committee Member
  • Adrianus C Van Duin, Committee Member

3. Development and Application of the ReaxFF Potential for Heterogeneous Catalysis and Metal Oxidation: Toward the Dynamic Sampling of Large Free Energy Surface

Open Access
Author:
Zou, Chenyu
Title:
Development and Application of the ReaxFF Potential for Heterogeneous Catalysis and Metal Oxidation: Toward the Dynamic Sampling of Large Free Energy Surface
Graduate Program:
Mechanical Engineering
Keywords:
File:
Committee Members:
  • Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
  • Adrianus C Van Duin, Committee Chair/Co-Chair
  • Michael John Janik, Committee Member
  • Donghai Wang, Committee Member
  • Lasse Jensen, Committee Member

4. Development of Structure-property Relationships for Intrinsically Microporous Polymers through Molecular Simulations

Open Access
Author:
Hart, Kyle E
Title:
Development of Structure-property Relationships for Intrinsically Microporous Polymers through Molecular Simulations
Graduate Program:
Materials Science and Engineering
Keywords:
File:
Committee Members:
  • Coray M Colina, Dissertation Advisor/Co-Advisor
  • William George Noid, Committee Member
  • James Patrick Runt, Committee Member
  • Adrianus C Van Duin, Committee Member

5. Electrochemical Energy Generation from Natural and Synthetic Salinity Gradients using Reverse Electrodialysis and Capacitive Mixing

Open Access
Author:
Hatzell, Marta Catherine
Title:
Electrochemical Energy Generation from Natural and Synthetic Salinity Gradients using Reverse Electrodialysis and Capacitive Mixing
Graduate Program:
Mechanical Engineering
Keywords:
File:
Committee Members:
  • Bruce Ernest Logan, Dissertation Advisor/Co-Advisor
  • Adrianus C Van Duin, Committee Member
  • Chao Yang Wang, Committee Member
  • Michael Anthony Hickner, Committee Member

6. Hyperthermal Oxidation and Pyrolysis of Carbon based Materials: Chemistry and Dynamics using the Reaxff Reactive Force Field

Open Access
Author:
Goverapet Srinivasan, Sriram
Title:
Hyperthermal Oxidation and Pyrolysis of Carbon based Materials: Chemistry and Dynamics using the Reaxff Reactive Force Field
Graduate Program:
Mechanical Engineering
Keywords:
File:
Committee Members:
  • Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
  • Zoubeida Ounaies, Committee Member
  • Randy Lee Vander Wal, Committee Member
  • Lasse Jensen, Committee Member

7. Improved Molecular Collision Models for Nonequilibrium Rarefied Gases

Open Access
Author:
Parsons, Neal S
Title:
Improved Molecular Collision Models for Nonequilibrium Rarefied Gases
Graduate Program:
Aerospace Engineering
Keywords:
File:
Committee Members:
  • Deborah A Levin, Dissertation Advisor/Co-Advisor
  • Adrianus C Van Duin, Committee Member
  • Michael Matthew Micci, Committee Member
  • Michael John Janik, Committee Member

8. Molecular dynamics analysis of oxidation, segregation and stress corrosion failures of refractory alloys

Open Access
Author:
Verners, Osvalds
Title:
Molecular dynamics analysis of oxidation, segregation and stress corrosion failures of refractory alloys
Graduate Program:
Mechanical Engineering
Keywords:
File:
Committee Members:
  • Adrianus C Van Duin, Dissertation Advisor/Co-Advisor
  • Adrianus C Van Duin, Committee Chair/Co-Chair
  • Md Amanul Haque, Committee Member
  • Zoubeida Ounaies, Committee Member
  • Sulin Zhang, Committee Member

9. Multiscale Chemo-mechanical Mechanics of High-capacity Anode Materials in Lithium-ion Nano-batteries

Open Access
Author:
Yang, Hui
Title:
Multiscale Chemo-mechanical Mechanics of High-capacity Anode Materials in Lithium-ion Nano-batteries
Graduate Program:
Engineering Science and Mechanics
Keywords:
File:
Committee Members:
  • Sulin Zhang, Dissertation Advisor/Co-Advisor
  • Sulin Zhang, Committee Chair/Co-Chair
  • Charles E Bakis, Committee Member
  • Long Qing Chen, Committee Member
  • Adrianus C Van Duin, Committee Member

10. Soot nanostructure evolution from gas turbine engine, premixed and diffusion flame: Equivalence ratio, flame temperature, and fuel dependencies.

Open Access
Author:
Huang, Chung-hsuan
Title:
Soot nanostructure evolution from gas turbine engine, premixed and diffusion flame: Equivalence ratio, flame temperature, and fuel dependencies.
Graduate Program:
Energy and Mineral Engineering
Keywords:
File:
Committee Members:
  • Randy Vander Wal, Dissertation Advisor/Co-Advisor
  • Randy Vander Wal, Committee Chair/Co-Chair
  • Andre Louis Boehman, Committee Member
  • Adrianus C Van Duin, Special Member
  • Thomas Litzinger, Special Member