| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1613383 | Journal of Alloys and Compounds | 2013 | 4 Pages |
Abstract
⺠Three types of lattice defect in M-H system were analyzed by computer simulation. ⺠T-site shift of H atoms in Mo-substituted VH0.5 was reproduced by DFT calculation. ⺠Aggregation of H atoms near the dislocation core was simulated by classical MD. ⺠Different mobility of dislocation was observed in pure and hydrogenated systems. ⺠Generation of fivefold symmetry in a hydrogenated bcc nanoparticle was simulated.
Related Topics
Physical Sciences and Engineering
Materials Science
Metals and Alloys
Authors
Hiroshi Ogawa,