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The local strain fields around an extended edge dislocation in copper are studied via the quasicontinuum multiscale simulation method combined with the virial strain calculation techniques. Results show that in the regions, tens of nanometers away from the dislocation, atoms are experiencing infinitesimal strain; virial strain calculation results are consistent with the predictions from elastic theory very well. In the regions near the dislocation, the virial strain fields can outline the core areas of Shockley partial dislocations precisely, which are in the shape of ellipse with a longer axis 7b1 and a shorter axis 3b1, where b1 is the length of burgers vector of the partial dislocation.
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Keywords:
- dislocation /
- strain analysis /
- atomistic simulation /
- multiscale
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[2] Pan J S, Tong J M, Tian M B 1998 Fundamentals of Materials Science(Beijing: Tsinghua University Press) p219 (in Chinese) [潘金生, 仝健民, 田民波1998 材料科学基础(北京: 清华大学出版社) 第219 页]
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[4] Wu X L, Ma E 2006 Appl. Phys. Lett. 88 231911
[5] Zhou N G, Zhou L, Du D X 2006 Acta Physica Sinica 55 372 (in Chinese)[周耐根, 周浪, 杜丹旭2006 55 372]
[6] Shimokawa T, Kinari T, Shintaku S 2007 Phys. Rev. B 75 144108
[7] Sansoz F, Stevenson K D 2011 Phys. Rev. B 83 224101
[8] Shao Y F, Yang X, Zhao X, Wang S Q 2012 Chin. Phys. B 21 083101
[9] Zhang B, Xia X M, Li Q 2012 Rare Metals 31 517
[10] Yu X X, Wang C Y 2013 Chin. Phys. B 22 027101
[11] Shan Z W, Wiezorek J M K, Stach E A, Follstaedt D M, Knapp J A, Mao S X 2007 Phys. Rev. Lett. 98 095502
[12] Wang L H, Han X D, Liu P, Yue Y H, Zhang Z, Ma E 2010 Phys. Rev. Lett. 105 135501
[13] Zhao C W, Xing Y M, Zhou C E, Bai P C 2008 Acta Mater. 56 2570
[14] Zhao C W, Xing Y M, Bai P C 2009 Chin. Phys. B 18 2464
[15] Woodward C 2005 Mater. Sci. Eng. A 400-401 59
[16] Chen L Q, Wang C Y, Yu T 2008 Chin. Phys. B 17 662
[17] Woodward C, Trinkle D R, Hector Jr L G, Olmsted D L 2008 Phys. Rev. Lett. 100 045507
[18] Chen L Q, Wang C Y, Yu T 2006 Acta Phys. Sin. 55 5980 (in Chinese)[陈丽群, 王崇愚, 于涛2006 55 5980]
[19] Dao M, Lu L, Asaro R J, De Hosson J T M, Ma E 2007 Acta Mater. 55 4041
[20] Jin Z H, Gumbsch P G, Albe K, Ma E, Lu K, Gleiter H, Hahn H 2008 Acta Mater. 56 1126
[21] Wang Y B, Sui M L 2009 Appl. Phys. Lett. 94 021909
[22] Miller R E, Tadmor E B 2002 J. Computer-Aided Mater. Design 9 203
[23] Mishin Y, Mehl M J, Papaconstantopoulos D A, Voter A F, Kress J D 2001 Phys. Rev. B 63 224106
[24] Kittel C 1986 Introduction to Solid State Physics (New York: Wiley-Interscience)
[25] Simons G, Wang H 1977 Single Crystal Elastic Constants and Calculated Aggregate Properties (Cambridge, MA: MIT Press)
[26] Carter C B, Ray I L F 1977 Philos. Mag 35 189
[27] Zimmermann J 1999 Ph. D. Dissertation (Stanford: Stanford University)
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[1] Hirth J P, Lothe J 1982 Theory of dislocation (New York: Wiley) p3
[2] Pan J S, Tong J M, Tian M B 1998 Fundamentals of Materials Science(Beijing: Tsinghua University Press) p219 (in Chinese) [潘金生, 仝健民, 田民波1998 材料科学基础(北京: 清华大学出版社) 第219 页]
[3] Swygenhoven H V, Derlet P M, Hasnaoui A 2002 Phys. Rev. B 66 024101
[4] Wu X L, Ma E 2006 Appl. Phys. Lett. 88 231911
[5] Zhou N G, Zhou L, Du D X 2006 Acta Physica Sinica 55 372 (in Chinese)[周耐根, 周浪, 杜丹旭2006 55 372]
[6] Shimokawa T, Kinari T, Shintaku S 2007 Phys. Rev. B 75 144108
[7] Sansoz F, Stevenson K D 2011 Phys. Rev. B 83 224101
[8] Shao Y F, Yang X, Zhao X, Wang S Q 2012 Chin. Phys. B 21 083101
[9] Zhang B, Xia X M, Li Q 2012 Rare Metals 31 517
[10] Yu X X, Wang C Y 2013 Chin. Phys. B 22 027101
[11] Shan Z W, Wiezorek J M K, Stach E A, Follstaedt D M, Knapp J A, Mao S X 2007 Phys. Rev. Lett. 98 095502
[12] Wang L H, Han X D, Liu P, Yue Y H, Zhang Z, Ma E 2010 Phys. Rev. Lett. 105 135501
[13] Zhao C W, Xing Y M, Zhou C E, Bai P C 2008 Acta Mater. 56 2570
[14] Zhao C W, Xing Y M, Bai P C 2009 Chin. Phys. B 18 2464
[15] Woodward C 2005 Mater. Sci. Eng. A 400-401 59
[16] Chen L Q, Wang C Y, Yu T 2008 Chin. Phys. B 17 662
[17] Woodward C, Trinkle D R, Hector Jr L G, Olmsted D L 2008 Phys. Rev. Lett. 100 045507
[18] Chen L Q, Wang C Y, Yu T 2006 Acta Phys. Sin. 55 5980 (in Chinese)[陈丽群, 王崇愚, 于涛2006 55 5980]
[19] Dao M, Lu L, Asaro R J, De Hosson J T M, Ma E 2007 Acta Mater. 55 4041
[20] Jin Z H, Gumbsch P G, Albe K, Ma E, Lu K, Gleiter H, Hahn H 2008 Acta Mater. 56 1126
[21] Wang Y B, Sui M L 2009 Appl. Phys. Lett. 94 021909
[22] Miller R E, Tadmor E B 2002 J. Computer-Aided Mater. Design 9 203
[23] Mishin Y, Mehl M J, Papaconstantopoulos D A, Voter A F, Kress J D 2001 Phys. Rev. B 63 224106
[24] Kittel C 1986 Introduction to Solid State Physics (New York: Wiley-Interscience)
[25] Simons G, Wang H 1977 Single Crystal Elastic Constants and Calculated Aggregate Properties (Cambridge, MA: MIT Press)
[26] Carter C B, Ray I L F 1977 Philos. Mag 35 189
[27] Zimmermann J 1999 Ph. D. Dissertation (Stanford: Stanford University)
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