Automatic kinetic Monte-Carlo modeling for impurity atom diffusion in grain boundary structure of tungsten material
The diffusion process of hydrogen and helium in plasma-facing material depends on the grain boundary structures. Whether a grain boundary accelerates or limits the diffusion speed of these impurity atoms is not well understood. In the present work, we proposed the automatic modeling of a kinetic Mon...
Main Authors: | , , , |
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Format: | Article |
Language: | English |
Published: |
Elsevier
2017-08-01
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Series: | Nuclear Materials and Energy |
Online Access: | http://www.sciencedirect.com/science/article/pii/S2352179116302198 |