Origin of the bismuth-induced decohesion of nickel and copper grain boundaries

Physical Review Letters

Volumn 111, Issue 5, 2013, Pages

  Kang, Joongoo ^a   Glatzmaier, Greg C ^a   Wei, Su Huai ^a  

^a NATIONAL RENEWABLE ENERGY LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRIC POLARIZATION EFFECTS; EXPERIMENTAL OBSERVATION; FIRST-PRINCIPLES CALCULATION; INTERFACIAL BONDS; INTERFACIAL PHASE; INTERGRANULAR FRACTURE; INTERLAYER BONDING; METASTABLE PHASE;

ADHESION; CALCULATIONS; GRAIN BOUNDARIES; IMPURITIES;

NICKEL;

EID: 84881510264     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.111.055502     Document Type: Article

References (25)

1. B. Joseph, M. Picat, and F. Barbier, Eur. Phys. J. Appl. Phys. 5, 19 (1999). EPAPFV 1286-0042 10.1051/epjap:1999108
2. P. J. L. Fernandes, R. E. Clegg, and D. R. H. Jones, Eng. Failure Anal. 1, 51 (1994). EFANEM 1350-6307 10.1016/1350-6307(94)90029-9 (Pubitemid 287839)
3. R. C. Hugo and R. G. Hoagland, Scr. Mater. 38, 523 (1998). SCMAF7 1359-6462 10.1016/S1359-6462(97)00464-8
4. W. Sigle, G. Richter, M. Rühle, and S. Schmidt, Appl. Phys. Lett. 89, 121911 (2006). APPLAB 0003-6951 10.1063/1.2356322 (Pubitemid 44439774)
5. W. Ludwig, E. Pereiro-López, and D. Bellet, Acta Mater. 53, 151 (2005). ACMAFD 1359-6454 10.1016/j.actamat.2004.09.012
6. K. Wolski and V. Laporte, Mater. Sci. Eng. A 495, 138 (2008). MSAPE3 0921-5093 10.1016/j.msea.2007.10.107
7. B. Joseph, F. Barbier, and M. Aucouturier, Scr. Mater. 40, 893 (1999). SCMAF7 1359-6462 10.1016/S1359-6462(99)00030-5
8. U. Alber, H. Müllejans, and M. Rühle, Acta Mater. 47, 4047 (1999). ACMAFD 1359-6454 10.1016/S1359-6454(99)00265-7 (Pubitemid 30516324)
9. K. Ina and H. Koizumi, Mater. Sci. Eng. A 387-389, 390 (2004). MSAPE3 0921-5093 10.1016/j.msea.2004.05.042 (Pubitemid 39648683)
10. R. Wu, A. J. Freeman, and G. B. Olson, Science 265, 376 (1994). SCIEAS 0036-8075 10.1126/science.265.5170.376
11. G. Duscher, M. F. Chisholm, U. Alber, and M. Rühle, Nat. Mater. 3, 621 (2004). NMAACR 1476-1122 10.1038/nmat1191
12. R. Schweinfest, A. T. Paxton, and M. W. Finnis, Nature (London) 432, 1008 (2004). NATUAS 0028-0836 10.1038/nature03198 (Pubitemid 40052227)
13. A. Y. Lozovoi, A. T. Paxton, and M. W. Finnis, Phys. Rev. B 74, 155416 (2006). PRBMDO 1098-0121 10.1103/PhysRevB.74.155416 (Pubitemid 44564633)
14. J. Luo, H. Cheng, K. M. Asl, C. J. Kiely, and M. P. Harmer, Science 333, 1730 (2011). SCIEAS 0036-8075 10.1126/science.1208774
15. M. P. Harmer, Science 332, 182 (2011). SCIEAS 0036-8075 10.1126/science.1204204
16. P. M. Anderson and J. R. Rice, Scr. Metall. 20, 1467 (1986). SCRMBU 0036-9748 10.1016/0036-9748(86)90377-7 (Pubitemid 17476704)
17. M. Yamaguchi, M. Shiga, and H. Kaburaki, Science 307, 393 (2005). SCIEAS 0036-8075 10.1126/science.1104624 (Pubitemid 40139977)
18. H.-S. Nam and D. J. Srolovitz, Phys. Rev. Lett. 99, 025501 (2007). PRLTAO 0031-9007 10.1103/PhysRevLett.99.025501 (Pubitemid 47117047)
19. R. J. Zamora, A. K. Nair, R. G. Hennig, and D. H. Warner, Phys. Rev. B 86, 060101 (2012). PRBMDO 1098-0121 10.1103/PhysRevB.86.060101
20. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996). PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
21. G. Kresse and J. Furthmüller, Phys. Rev. B 54, 11 169 (1996). PRBMDO 0163-1829 10.1103/PhysRevB.54.11169
22. See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevLett.111.055502 for details on the calculation method and supplemental figures.
23. S. Ma, K. M. Asl, C. Tansarawiput, P. R. Cantwell, M. Qi, M. P. Harmer, and J. Luo, Scr. Mater. 66, 203 (2012). SCMAF7 1359-6462 10.1016/j.scriptamat. 2011.10.011
24. T. E. Jones, M. E. Eberhart, S. Imlay, C. Mackey, and G. B. Olson, Phys. Rev. Lett. 109, 125506 (2012). PRLTAO 0031-9007 10.1103/PhysRevLett.109.125506
25. A. Kundu, K. M. Asl, J. Luo, and M. P. Harmer, Scr. Mater. 68, 146 (2013). SCMAF7 1359-6462 10.1016/j.scriptamat.2012.10.012