An Atomistic Modeling Study of Alloying Element Impurity Element, and Transmutation Products on the cohesion of A Nickel E5 {l_brace}001{r_brace} Twist Grain Boundary

Abstract

This report was prepared as an account of work sponsored by the United States Government. Neither the United States, nor the United States Department of Energy, nor any of their employees, nor any of their contractors, subcontractors, or their employees, makes any warranty, express or implied, or assumes any legal liability or responsibility for the accuracy, completeness or usefulness of any information, apparatus, product or process disclosed, or represents that its use would not infringe privatety owned rights. An Atomistic Modeling Study of Alloying Element, Impurity Element, and Transmutation Products on the Cohesion of a Nickel c5 (001) Twist Grain Boundary Phonons Phonons Chemical and Other Chemical reaction rates Photochemical properties Properties