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Elastic Properties of High-Symmetry Sb4O6 Cage-Molecular Crystal.

Congcong WuJun PengWeiwen PuShengnan LuChao ZhangNan WuZhaoru SunHongti ZhangHung-Ta Wang
Published in: The journal of physical chemistry letters (2021)
The cubic-phase antimony trioxide (α-Sb2O3) is a room-temperature stable molecular crystal, composed of cage-like tetraantimony hexoxide (Sb4O6) molecules. Despite its versatile functionality, the van der Waals (vdW) bond-dominated nanomechanics is still unclear. Here, the bending plate-like linear behaviors of high-quality α-Sb2O3 nanoflakes were observed using the nanoindentation method. It is found that the cage-molecular crystal owns a very low in-plane Young's modulus of 14.9 ± 0.8 GPa and a remarkable maximum tensile strain of 6.0-8.8%, corresponding to a rupture strength of 0.89-1.31 GPa. Elucidated by the atomistic simulations, the compliant elastic modulus and the unexpectedly strong rupture strain are associated with the high-symmetry vdW bonding structure. The vdW nanomechanics is of fundamental and technological relevance to nanoelectronics.
Keyphrases
  • room temperature
  • single molecule
  • ionic liquid
  • molecular dynamics simulations
  • solid state
  • middle aged