Srinivasan S G, Liao X Z, Baskes M I, McCabe R J, Zhao Y H, Zhu Y T
Materials Sciences Division, Los Alamos National Laboratory, Los Alamos, NM 87545, USA.
Phys Rev Lett. 2005 Apr 1;94(12):125502. doi: 10.1103/PhysRevLett.94.125502. Epub 2005 Mar 30.
Atomistic simulations, confirmed by electron microscopy, show that dislocations in aluminum can have compact or dissociated cores. The calculated minimum stress (sigma(P)) required to move an edge dislocation is approximately 20 times smaller for dissociated than for equivalent compact dislocations. This contradicts the well accepted generalized stacking fault energy paradigm that predicts similar sigma(P) values for both configurations. Additionally, Frank's rule and the Schmid law are also violated because dislocation core energies become important. These results may help settle a 50-year-old puzzle regarding the magnitude of sigma(P) in face-centered-cubic metals, and provide new insights into the deformation of ultra-fine-grained metals.
经电子显微镜证实的原子模拟表明,铝中的位错可具有紧密或扩展的核心。计算得出,移动一个刃型位错所需的最小应力(σ(P)),对于扩展位错而言,大约比等效紧密位错小20倍。这与广为接受的广义堆垛层错能范式相矛盾,该范式预测两种构型的σ(P)值相似。此外,由于位错核心能量变得重要,弗兰克规则和施密德定律也被违反。这些结果可能有助于解决一个关于面心立方金属中σ(P)大小的长达50年的谜题,并为超细晶粒金属的变形提供新的见解。