Literature DB >> 24160612

Universal medium-range order of amorphous metal oxides.

Kengo Nishio1, Takehide Miyazaki, Hisao Nakamura.   

Abstract

We propose that the structure of amorphous metal oxides can be regarded as a dual-dense-random-packing structure, which is a superposition of the dense random packing of metal atoms and that of oxygen atoms. Our ab initio molecular dynamics simulations show that the medium-range order of amorphous HfO2, ZrO2, TiO2, In2O3, Ga2O3, Al2O3, and Cu2O is characterized by the pentagonal-bipyramid arrangement of metal atoms and that of oxygen atoms, and prove the validity of our dual-random-sphere-packing model. In other words, we find that the pentagonal medium-range order is universal independent of type of metal oxide.

Entities:  

Year:  2013        PMID: 24160612     DOI: 10.1103/PhysRevLett.111.155502

Source DB:  PubMed          Journal:  Phys Rev Lett        ISSN: 0031-9007            Impact factor:   9.161


  4 in total

1.  The Structure and Properties of Amorphous Indium Oxide.

Authors:  D Bruce Buchholz; Qing Ma; Diego Alducin; Arturo Ponce; Miguel Jose-Yacaman; Rabi Khanal; Julia E Medvedeva; Robert P H Chang
Journal:  Chem Mater       Date:  2014-09-02       Impact factor: 9.811

2.  The Structure of Liquid and Amorphous Hafnia.

Authors:  Leighanne C Gallington; Yasaman Ghadar; Lawrie B Skinner; J K Richard Weber; Sergey V Ushakov; Alexandra Navrotsky; Alvaro Vazquez-Mayagoitia; Joerg C Neuefeind; Marius Stan; John J Low; Chris J Benmore
Journal:  Materials (Basel)       Date:  2017-11-10       Impact factor: 3.623

3.  Describing polyhedral tilings and higher dimensional polytopes by sequence of their two-dimensional components.

Authors:  Kengo Nishio; Takehide Miyazaki
Journal:  Sci Rep       Date:  2017-01-17       Impact factor: 4.379

4.  How to describe disordered structures.

Authors:  Kengo Nishio; Takehide Miyazaki
Journal:  Sci Rep       Date:  2016-04-11       Impact factor: 4.379

  4 in total

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