Anatase-TiO2 nanomaterials: Analysis of key parameters controlling crystallization

Marcos Fernández-García, Carolina Belver, Jonathan C. Hanson, Xianqin Wang, José A. Rodriguez

Research output: Contribution to journalArticlepeer-review

80 Scopus citations


Nanoparticulated TiO2 materials with anatase structure were synthesized by using a microemulsion method. The structural characteristics of the amorphous solid precursors and their evolution during thermal treatments were studied by using X-ray absorption structure (X-ray absorption near edge structure XANES and extended X-ray absorption fine structure EXAFS), XRD-PDF (X-ray diffraction-pair distribution function), and infrared spectroscopy. Concerning the precursor materials, XANES and EXAFS showed a local order closely related to that of the anatase structure but containing defective, undercoordinated Ti504+ species in addition to normal Ti6c4+ species. The PDF technique detects differences among samples in the local order (below 1 nm) and showed that primary particle size varies throughout the amorphous precursor series. The physical interpretation of results concerning the amorphous materials and their evolution under thermal treatment gives conclusive evidence that local, intraparticle ordering variations determine the temperature for the onset of the nucleation process and drive the solid behavior through the whole crystallization process. The significance of this result in the context of current crystallization theories of oxide-based nanocrystalline solids is discussed.

Original languageEnglish (US)
Pages (from-to)13604-13612
Number of pages9
JournalJournal of the American Chemical Society
Issue number44
StatePublished - Nov 7 2007
Externally publishedYes

All Science Journal Classification (ASJC) codes

  • Catalysis
  • General Chemistry
  • Biochemistry
  • Colloid and Surface Chemistry


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