4.8 Article

Role of the Mineral in the Self-Healing of Cracks in Human Enamel

Journal

ACS NANO
Volume -, Issue -, Pages -

Publisher

AMER CHEMICAL SOC
DOI: 10.1021/acsnano.1c10407

Keywords

self-healing; enamel; hydroxyapatite; calcite; molecular dynamics; simulations

Funding

  1. National Science Foundation (NSF) [1122374]
  2. National Energy Research Scientific Computing Center (NERSC) at Lawrence Berkeley National Laboratory [m3650]
  3. National Institute of Dental and Craniofacial Research (NIH/NIDCR) [R21DE029604]
  4. U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences, Chemical Sciences, Geosciences, and Biosciences Division [DE-FG02-07ER15899, FP00011135]
  5. NSF [DMR-1603192]
  6. ONR [N000141612333, N000141912375]
  7. AFOSR [FATE MURI FA9550-15-1-0514]
  8. NIH [U01HH4977, U01EB014976, U01EB016422]

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Human enamel is a resilient biological material with various mechanisms contributing to its toughness. In this study, the authors focus on the mineral aspect and propose that self-healing of cracks in enamel nanocrystals may prevent catastrophic failure. By comparing the fracture behavior of hydroxyapatite and calcite, the main minerals in human enamel and sea urchin teeth respectively, they find that cracks heal in hydroxyapatite but not in calcite. This self-healing mechanism is unique in the human body and materials science.
Human enamel is an incredibly resilient biological material, withstanding repeated daily stresses for decades. The mechanisms behind this resilience remain an open question, with recent studies demonstrating a crackdeflection mechanism contributing to enamel toughness and other studies detailing the roles of the organic matrix and remineralization. Here, we focus on the mineral and hypothesize that self-healing of cracks in enamel nanocrystals may be an additional mechanism acting to prevent catastrophic failure. To test this hypothesis, we used a molecular dynamics (MD) approach to compare the fracture behavior of hydroxyapatite (HAP) and calcite, the main minerals in human enamel and sea urchin teeth, respectively. We find that cracks heal under pressures typical of mastication by fusion of crystals in HAP but not in calcite, which is consistent with the resilience of HAP enamel that calcite teeth lack. Scanning transmission electron microscopy (STEM) images of structurally intact (sound) human enamel show dashed-line nanocracks that resemble and therefore might be the cracks healed by fusion of crystals produced in silico. The fast, self-healing mechanism shown here is common in soft materials and ceramics but has not been observed in single crystalline materials at room temperature. The crack self-healing in sound enamel nanocrystals, therefore, is unique in the human body and unique in materials science, with potential applications in designing bioinspired materials.

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