Unusually Large Young's Moduli of Amino Acid Molecular Crystals

被引:96
作者
Azuri, Ido [1 ]
Meirzadeh, Elena [1 ]
Ehre, David [1 ]
Cohen, Sidney R. [2 ]
Rappe, Andrew M. [3 ]
Lahav, Meir [1 ]
Lubomirsky, Igor [1 ]
Kronik, Leeor [1 ]
机构
[1] Weizmann Inst Sci, Dept Mat & Interfaces, IL-76100 Rehovot, Israel
[2] Weizmann Inst Sci, Chem Res Support, IL-76100 Rehovot, Israel
[3] Univ Penn, Dept Chem, Makineni Theoret Labs, Philadelphia, PA 19104 USA
基金
以色列科学基金会;
关键词
amino acids; crystallography; density functional calculations; mechanical properties; Young's modulus; MECHANICAL-PROPERTIES; ELASTIC PROPERTIES; PHASE-TRANSITION; ALPHA-GLYCINE; BETA-GLYCINE; NANOINDENTATION; INDENTATION; PLASTICITY; PRESSURE; BEHAVIOR;
D O I
10.1002/anie.201505813
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Young's moduli of selected amino acid molecular crystals were studied both experimentally and computationally using nanoindentation and dispersion-corrected density functional theory. The Young modulus is found to be strongly facet-dependent, with some facets exhibiting exceptionally high values (as large as 44GPa). The magnitude of Young's modulus is strongly correlated with the relative orientation between the underlying hydrogen-bonding network and the measured facet. Furthermore, we show computationally that the Young modulus can be as large as 70-90GPa if facets perpendicular to the primary direction of the hydrogen-bonding network can be stabilized. This value is remarkably high for a molecular solid and suggests the design of hydrogen-bond networks as a route for rational design of ultra-stiff molecular solids.
引用
收藏
页码:13566 / 13570
页数:5
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