Nanocrystalline cerium oxide is an attractive material for catalysis of environmentally hazardous gas-phase species such as sulfur dioxide and carbon monoxide. Oxygen vacancies in cerium oxide are believed to coordinate and aid in the transfer of oxygen ions between the reactive species. We have sought to characterize these defects in nanocrystalline cerium oxide as a function of the heat treat...

Natural bone consists of hard nanostructured hydroxyapatite (HA) in a nanostructured protein-based soft hydrogel template (ie, mostly collagen). For this reason, nanostructured HA has been an intriguing coating material on traditionally used titanium for improving orthopedic applications. In addition, helical rosette nanotubes (HRNs), newly developed materials which form through the self-assemb...

In recent years, near-nano (submicron) and nanostructured materials have attracted increasingly more attention from the materials community. Nanocrystalline materials are characterized by a microstructural length or grain size of up to about 100 nm. Materials having grain size of 0.1 to 0.3 mm are classified as submicron materials. Nanocrystalline materials exhibit various shapes or forms, and ...

We measured the phonon density of states (DOS) of nanocrystalline Fe by resonant inelastic nuclear g-ray scattering. The nanophase material shows large distortions in its phonon DOS. We attribute the high energy distortion to lifetime broadening. A damped harmonic oscillator model for the phonons provides a low quality factor, Qu, averaging about 5, but the longitudinal modes may have been broa...

Nanocrystalline diamond films have attracted considerable attention because they have a low coefficient of friction and a low electron emission threshold voltage. In this paper, the author reviews the plasma-enhanced chemical vapor deposition (PE-CVD) of nanocrystalline diamond and mainly focuses on the growth of nanocrystalline diamond by low-pressure PE-CVD. Nanocrystalline diamond particles ...

The surface morphology, elemental composition, and nanohardness of thin fullerite–aluminum films with different atomic fractions metal are investigated by scanning electron atomic-force microscopies, X-ray spectral microanalysis nanoindentation. obtained the method resistive evaporation in vacuum from a combined atomic-molecular flux Al atoms C60 molecules on single-crystal silicon substrates o...

We have developed a first-principles-based hierarchical simulation framework, which seamlessly integrates (1) a quantum mechanical description based on the density functional theory (DFT), (2) multilevel molecular dynamics (MD) simulations based on a reactive force field (ReaxFF) that describes chemical reactions and polarization, a nonreactive force field that employs dynamic atomic charges, a...

The incorporation of Al and increased curing temperature promotes the crystallization and cross-linking of calcium (alumino)silicate hydrate (C-(A-)S-H), which is the primary binding phase in most contemporary concrete materials. However, the influence of Al-induced structural changes on the mechanical properties at atomistic scale is not well understood. Herein, synchrotron radiation-based hig...