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Investigation of structure and energy of edge dislocation in bcc iron
L. Q. Chen; C. Y. Wang; T. Yu
2006
Source PublicationActa Physica Sinica
ISSN1000-3290
Volume55Issue:11Pages:5980-5986
AbstractBased on the theory of dislocations, we have constructed the four models of the < 100 > {010}, < 100 > {011}, 1/2 < 111 > {001} and 1/2 < 111 > {112} edge dislocations in bcc Fe using the molecular dynamics method, and the formation energy, core energy and core radius of the dislocations have been calculated respectively. The calculated results indicated that the formation energies of < 100 > {010} and < 100 > {011} edge dislocations are higher than those of 1/2 < 111 > {011} and 1/2 < 111 > {112} edge dislocations. This shows that the formation of 1/2 < 111 > edge dislocation is easier than that of (100) edge dislocation. However, the core radii of < 100 > {010} and < 100 > {011} edge dislocations are smaller than those of 1/2 < 111 > {011} and 1/2 < 111 > {112} edge dislocations. This shows that the atomic numbers locating at the singular region in the 1/2 < 111 > edge dislocation are greater than those in < 100 > edge dislocation. Therefore, the motion of 1/2 < 111 > edge dislocation is easier than that of < 100 > edge dislocation.
description.departmentcent iron & steel res inst, inst funct mat, beijing 100081, peoples r china. tsing hua univ, dept phys, beijing 100084, peoples r china. chinese acad sci, int ctr mat phys, shenyang 110016, peoples r china.;chen, lq (reprint author), cent iron & steel res inst, inst funct mat, beijing 100081, peoples r china;clqun123@sohu.com
KeywordBcc Fe Edge Dislocation Molecular Dynamics Simulation Transition-metals Core Structure Alpha-iron
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WOS IDWOS:000241880000067
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Cited Times:12[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Identifierhttp://ir.imr.ac.cn/handle/321006/34146
Collection中国科学院金属研究所
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L. Q. Chen,C. Y. Wang,T. Yu. Investigation of structure and energy of edge dislocation in bcc iron[J]. Acta Physica Sinica,2006,55(11):5980-5986.
APA L. Q. Chen,C. Y. Wang,&T. Yu.(2006).Investigation of structure and energy of edge dislocation in bcc iron.Acta Physica Sinica,55(11),5980-5986.
MLA L. Q. Chen,et al."Investigation of structure and energy of edge dislocation in bcc iron".Acta Physica Sinica 55.11(2006):5980-5986.
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