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Strengthening Mg by self-dispersed nano-lamellar faults

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journal contribution
posted on 2017-04-05, 04:02 authored by William Yi Wang, Yi Wang, Shun Li Shang, Kristopher A. Darling, Hongyeun Kim, Bin Tang, Hong Chao Kou, Suveen N. Mathaudhu, Xi Dong Hui, Jin Shan Li, Laszlo J. Kecskes, Zi-Kui Liu

Here, we show the strategies to strengthen Mg alloys through modifying the matrix by planar faults and optimizing the local lattice strain by solute atoms. The anomalous shifts of the local phonon density of state of stacking faults (SFs) and long periodic stacking-ordered structures (LPSOs) toward the high-frequency mode are revealed by HCP-FCC transformation, resulting in the increase of vibrational entropy and the decrease of free energy to stabilize the SFs and LPSOs. Through integrating bonding charge density and electronic density of states, electronic redistributions are applied to reveal the electronic basis for the ‘strengthening’ of Mg alloys.

IMPACT STATEMENT

Through integrating the bonding charge density, the phonon and electronic density of states, this work provides an atomic and electronic insight into the strengthening mechanism of Mg alloys.

Funding

This work was financially supported by the United States National Science Foundation [Grant No. DMR-1006557], Army Research Laboratory [W911NF-08-2-0084], and National Natural Science Foundation of China [Grant Nos. 51690163 and 51071018]. WYW acknowledges the support from the Fundamental Research Funds for the Central Universities in China [G2016KY0302 and 3102015BJ(II)JGZ005]. SNM acknowledges support of the National Science Foundation under grant number 1444632. Also funded by NSF through grant [OCI-0821527] and the cluster through XSEDE grant [TG-DMR-140033 and TG-DMR-140063].

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