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First-principles computation of random-pinning glass transition, glass cooperative length scales, and numerical comparisons

Chiara Cammarota and Beatriz Seoane
Phys. Rev. B 94, 180201(R) – Published 3 November 2016

Abstract

As a guideline for experimental tests of the ideal glass transition (random-pinning glass transition, RPGT) that shall be induced in a system by randomly pinning particles, we performed first-principle computations within the hypernetted chain approximation and numerical simulations of a hard-sphere model of a glass former. We obtain confirmation of the expected enhancement of glassy behavior under the procedure of random pinning. We present the analytical phase diagram as a function of c and of the packing fraction ϕ, showing a line of RPGT ending in a critical point. We also obtain microscopic results on cooperative length scales characterizing medium-range amorphous order in hard-sphere glasses and indirect quantitative information on a key thermodynamic quantity defined in proximity to ideal glass transitions, the amorphous surface tension. Finally, we present numerical results of pair correlation functions able to differentiate the liquid and the glass phases, as predicted by the analytic computations.

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  • Received 3 November 2015
  • Revised 15 September 2016

DOI:https://doi.org/10.1103/PhysRevB.94.180201

©2016 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Chiara Cammarota*

  • Mathematics Department, King's College London, Strand WC2R 2LS, United Kingdom and Physics Department of “La Sapienza”, University of Rome, Piazzale Aldo Moro 2, 00185 Rome, Italy

Beatriz Seoane

  • Laboratoire de Physique Théorique, ENS & PSL University, UPMC & Sorbonne Universités, UMR 8549 CNRS, 75005 Paris, France and Instituto de Biocomputación y Física de Sistemas Complejos (BIFI), 50009 Zaragoza, Spain

  • *chiara.cammarota@kcl.ac.uk
  • beatriz.seoane.bartolome@lpt.ens.fr

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Issue

Vol. 94, Iss. 18 — 1 November 2016

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