Phase stability and grain boundary structure in the Cu-Bi system

Journal of Phase Equilibria

Volumn 18, Issue 6, 1997, Pages 562-566

  Siegl, R ^a   Vitek, V ^a   Luzzi, D E ^a   Yan, M ^b  

^a UNIVERSITY OF PENNSYLVANIA   (United States)

^b LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; CRYSTAL ATOMIC STRUCTURE; CRYSTAL GROWTH; ENTHALPY; GRAIN BOUNDARIES;

FINNIS SINCLAIR POTENTIAL; PHASE STABILITY;

COPPER ALLOYS;

EID: 0031333112     PISSN: 10549714     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02665812     Document Type: Article

References (20)

1. B. Blum, M. Menyhard, D.E. Luzzi, and C.J. McMahon, Jr., "TEM Investigation of Bismuth Induced Faceting of Σ = 3 and Near Σ = 3 Grain Boundaries in Copper," Scr. Met. Mater., 24, 2169-2173 (1990).
2. E.C. Urdaneta, D.E. Luzzi, and C.J. McMahon, Jr., "Grain Boundary Transformations in Bi-Doped Copper," Structure and Properties of Interfaces in Materials, W.A.T. Clark, U. Dahmen, and C.L. Briant, Ed., Vol. 238, Materials Research Society, Pittsburgh, PA, 201-205 (1992).
3. E.C. Urdaneta, "Grain Boundary Transformations: A Crystallographic Study of Boundary Faceting in Bismuth-Doped Copper Polycrystals," Ph.D. thesis, University of Pennsylvania, 157-169 (1993).
4. M. Menyhard, B. Blum, C.J. McMahon, Jr., S. Chikwambani, and J. Weertman, "Bismuth Segregation in Cu-Bi Bicrystals," J. Phys., 49, C5-457-C5-462 (1988).
5. M. Menyhard, B. Blum, and C.J. McMahon, Jr., "Grain Boundary Segregation and Transformations in Bi-Doped Polycrystalline Copper," Acta Metall. Mater., 37, 549-557 (1989).
6. U. Wolf, F. Ernst, T. Muschik, M.W. Finnis, and H.F. Fischmeister, "The Influence of Grain Boundary Inclination on the Structure and Energy of E3 Twin Boundaries in Copper," Structure and Properties of Interfaces in Materials, W.A.T. Clark, U. Dahmen, and C.L. Briant, Ed., Vol. 238, Materials Research Society, Pittsburgh, PA, 177-182 (1992).
7. U. Wolf, F. Ernst, T. Muschik, M.W. Finnis, and H.F. Fischmeister, "The Influence of Grain Boundary Inclination on the Structure and Energy of Σ = 3 Grain Boundaries in Copper," Philos. Mag. A, 66, 991-1016 (1992).
8. F. Ernst, M.W. Finnis, D. Hofmann, T. Muschik, U. Schönberger, and U. Wolf, "Theoretical Prediction and Direct Observation of the 9R Structure in Ag," Phys. Rev. Lett., 69, 620-623 (1992).
9. T. Muschik, W. Laub, M.W. Finnis, and W. Gust, "Thermodynamics of Faceting of Σ3 Grain Boundaries in Cu," Z. Metallkd., 84, 596-604 (1993).
10. D. Hofmann and M.W. Finnis, "Theoretical and Experimental Analysis of Near Σ3 (211) Boundaries in Silver," Acta Metall. Mater., 42, 3555-3567 (1994).
11. D.E. Luzzi, "High-Resolution Electron Microscopy Observations of Faceted Grain Boundaries and Twins in Bismuth-Doped Copper," Ultramicmscopy, 37, 180-190 (1991).
12. D.E. Luzzi, "Direct Imaging of Ordered Segregation Layers in Copper Doped with Bismuth," Philos. Mag. Lett., 63, 281-287 (1991).
13. D.E. Luzzi, M. Yan, M. Sob, and V. Vitek, "Atomic Structure of a Grain Boundary in a Metallic Alloy: Combined Electron Microscope and Theoretical Study," Phys. Rev. Lett., 67, 1894-1897 (1991).
14. M. Yan, M. Sob, D.E. Luzzi, V. Vitek, G.J. Ackland, M. Methfessel, and C.O. Rodriguez, "Interatomic Forces and Atomic Structure of Grain Boundaries in Copper-Bismuth Alloys," Phys. Rev. B, 47, 5571-5582 (1993).
15. O.K. Andersen, O. Jepsen, and D. Glotzel, "Canonical Description of the Band Structure of Metals," Highlights of Condensed Matter Theory, F. Bassani, F. Fumi, and M.P. Tosi, Ed., North Holland, Amsterdam, 59-176 (1985).
16. M. Methfessel, "Elastic Constants and Phonon Frequencies of Si Calculated By a Fast Full-Potential Linear-Muffin-Tin-Otbital Method," Phys. Rev. B, 38, 1537-1540 (1988).
17. M. Methfessel, C.O. Rodriguez, and O.K. Andersen, "Fast Full-Potential Calculations with a Converged Basis of Atom-Centered Linear Muffin-Tin Orbitals: Structural and Dynamic Properties of Silicon," Phys. Rev. B, 40, 2009-2012 (1989).
18. M. Asta, D. de Fontaine, M. van Schilfgaarde, M. Sluiter, and M. Methfessel, "First-Principles Phase Stability Study of FCC Alloys in the Ti-Al System," Phys. Rev. B, 46, 5055-5072 (1992).
19. M.W. Finnis and J.E. Sinclair, "A Simple Empirical N-Body Potential for Transition Metals," Philos. Mag. A, 50, 45-55 (1984).
20. M.S. Daw and M.I. Baskes, "Embedded-Atom Method: Derivation and Application to Impurities, Surfaces, and Other Defects in Metals," Phys. Rev. B, 29, 6443-6453 (1984).