Browsing by Author "Donald Brenner, Chair"

Now showing 1 - 8 of 8

Ad-hoc Solutions for Capturing Electronic Structure Details in Classical Dynamics Simulations.
(2013-07-08) Crill, John Wesley; Donald Brenner, Chair; Douglas Irving, Co-Chair; Mohammed Zikry, Minor; Yaroslava Yingling, Member
Atomistic Insights into the Structure and Dynamics of Hydration Layers of the Detonation Nanodiamond with various Surface Chemistries in the Aqueous Solution of Inorganic Salts.
(2020-06-05) Saberi Movahed, Farshad; Donald Brenner, Chair; Brian Reich, Member; Douglas Irving, Member; Jacqueline Krim, Member
Computational Study of Grain Boundaries and Nano-Reactive Materials
(2015-05-12) Lu, Shijing; Donald Brenner, Chair; Douglas Irving, Member; Korukonda Murty, Minor; Carl Koch, Member
First-Principles Informed Thermodynamics of CRUD Deposition.
(2013-09-03) O'Brien, Christopher John; Douglas Irving, Co-Chair; Donald Brenner, Chair; Jon-Paul Maria, Member; Korukonda Murty, Member
Interaction of Defects and Disorder in High-Entropy Ceramics: Simulation of Random Solid Solutions from First Principles.
(2023-12-04) Daigle, Samuel Evan; Donald Brenner, Chair; Jacob Jones, Member; Douglas Irving, Member; Ralph Smith, Member
Molecular Dynamics Simulations: Analysis for characterizing simulated atomic-scale defects in crystal, and Kinetic Analysis of Ethylene-Propylene Diene-Terpolymer(EPDM) pyrolysis using ReaxFF
(2017-08-04) Li, Dong; Donald Brenner, Chair; Douglas Irving, Member; Yaroslava Yingling, Member; Brian Reich, Member
Molecular Model for the Interaction of Charged Nano-Particles with Metal Surfaces.
(2019-11-04) Su, Liangliang; Donald Brenner, Chair; Jacqueline Krim, Member; Christopher Roland, Member; Alexej Smirnov, Member
Understanding the Thermal, Structural, and Electrical Properties of the High Entropy Ceramics, High Entropy Oxides and Carbides, using Computational Modeling.
(2020-08-12) Lim, Mina; Donald Brenner, Chair; Jon-Paul Maria, Member; Srikanth Patala, Member; Melissa Pasquinelli, Member