Literature DB >> 31484781

Potential energy landscape activations governing plastic flows in glass rheology.

Penghui Cao1,2, Michael P Short3, Sidney Yip3,4.   

Abstract

While glasses are ubiquitous in natural and manufactured materials, the atomic-level mechanisms governing their deformation and how these mechanisms relate to rheological behavior are still open questions for fundamental understanding. Using atomistic simulations spanning nearly 10 orders of magnitude in the applied strain rate we probe the atomic rearrangements associated with 3 characteristic regimes of homogeneous and heterogeneous shear flow. In the low and high strain-rate limits, simulation results together with theoretical models reveal distinct scaling behavior in flow stress variation with strain rate, signifying a nonlinear coupling between thermally activated diffusion and stress-driven motion. Moreover, we find the emergence of flow heterogeneity is closely correlated with extreme values of local strain bursts that are not readily accommodated by immediate surroundings, acting as origins of shear localization. The atomistic mechanisms underlying the flow regimes are interpreted by analyzing a distance matrix of nonaffine particle displacements, yielding evidence of various barrier-hopping processes on a fractal potential energy landscape (PEL) in which shear transformations and liquid-like regions are triggered by the interplay of thermal and stress activations.

Keywords:  atomistic modeling; mechanism; metallic glass; rheology

Year:  2019        PMID: 31484781      PMCID: PMC6754557          DOI: 10.1073/pnas.1907317116

Source DB:  PubMed          Journal:  Proc Natl Acad Sci U S A        ISSN: 0027-8424            Impact factor:   11.205


  40 in total

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Journal:  Nature       Date:  2001-03-08       Impact factor: 49.962

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Journal:  Phys Rev Lett       Date:  2005-08-26       Impact factor: 9.161

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Journal:  Phys Rev Lett       Date:  2005-11-03       Impact factor: 9.161

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Journal:  Phys Rev E Stat Nonlin Soft Matter Phys       Date:  2006-06-26

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Authors:  Craig E Maloney; Anaël Lemaître
Journal:  Phys Rev E Stat Nonlin Soft Matter Phys       Date:  2006-07-25

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Journal:  Eur Phys J E Soft Matter       Date:  2006-07-24       Impact factor: 1.890

8.  Activation energy of shear transformation zones: a key for understanding rheology of glasses and liquids.

Authors:  S G Mayr
Journal:  Phys Rev Lett       Date:  2006-11-06       Impact factor: 9.161

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Authors:  Nicholas P Bailey; Jakob Schiøtz; Anaël Lemaître; Karsten W Jacobsen
Journal:  Phys Rev Lett       Date:  2007-02-28       Impact factor: 9.161

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Authors:  G A Appignanesi; J A Rodríguez Fris; R A Montani; W Kob
Journal:  Phys Rev Lett       Date:  2006-02-08       Impact factor: 9.161

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  1 in total

1.  Internal constraints and arrested relaxation in main-chain nematic elastomers.

Authors:  Takuya Ohzono; Kaoru Katoh; Hiroyuki Minamikawa; Mohand O Saed; Eugene M Terentjev
Journal:  Nat Commun       Date:  2021-02-04       Impact factor: 14.919

  1 in total

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