Keyword: replica exchange molecular dynamics

Restricted (Penn State Only)

Author:: Khan, Mohd Ahmed
Title:: Size and Temperature Dependent Shapes of Copper Nanocrystals using Replica-Exchange Molecular Dynamics Simulations
Graduate Program:: Chemical Engineering
Keywords:: copper
replica exchange molecular dynamics
common neighbor analysis
embedded atom method
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Committee Members:: Seong Kim, Professor in Charge/Director of Graduate Studies
Kristen Fichthorn, Thesis Advisor/Co-Advisor
Ali Borhan, Committee Member
Ismaila Dabo, Committee Member

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