Literature DB >> 11135996

Energy landscape of a lennard-jones liquid: statistics of stationary points.

K Broderix1, K K Bhattacharya, A Cavagna, A Zippelius, I Giardina.   

Abstract

Molecular dynamics simulations are used to generate an ensemble of saddles of the potential energy of a Lennard-Jones liquid. Classifying all extrema by their potential energy u and number of unstable directions k, a well-defined relation k(u) is revealed. The degree of instability of typical stationary points vanishes at a threshold potential energy u(th), which lies above the energy of the lowest glassy minima of the system. The energies of the inherent states, as obtained by the Stillinger-Weber method, approach u(th) at a temperature close to the mode-coupling transition temperature T(c).

Year:  2000        PMID: 11135996     DOI: 10.1103/PhysRevLett.85.5360

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


  10 in total

1.  Molecular dynamics studies of heterogeneous dynamics and dynamic crossover in supercooled atomic liquids.

Authors:  Hans C Andersen
Journal:  Proc Natl Acad Sci U S A       Date:  2005-05-03       Impact factor: 11.205

2.  Liquid-structure forces and electrostatic modulation of biomolecular interactions in solution.

Authors:  Sergio A Hassan
Journal:  J Phys Chem B       Date:  2007-01-11       Impact factor: 2.991

3.  Equilibrium phase diagram of a randomly pinned glass-former.

Authors:  Misaki Ozawa; Walter Kob; Atsushi Ikeda; Kunimasa Miyazaki
Journal:  Proc Natl Acad Sci U S A       Date:  2015-05-14       Impact factor: 11.205

4.  The glass transition in a nutshell: a source of inspiration to describe the subcritical transition to turbulence.

Authors:  Olivier Dauchot; Eric Bertin
Journal:  Eur Phys J E Soft Matter       Date:  2014-04-28       Impact factor: 1.890

5.  Spin glasses and fragile glasses: statics, dynamics, and complexity.

Authors:  Giorgio Parisi
Journal:  Proc Natl Acad Sci U S A       Date:  2006-05-11       Impact factor: 11.205

6.  Critical Point-Finding Methods Reveal Gradient-Flat Regions of Deep Network Losses.

Authors:  Charles G Frye; James Simon; Neha S Wadia; Andrew Ligeralde; Michael R DeWeese; Kristofer E Bouchard
Journal:  Neural Comput       Date:  2021-05-13       Impact factor: 2.026

7.  Universal law for the vibrational density of states of liquids.

Authors:  Alessio Zaccone; Matteo Baggioli
Journal:  Proc Natl Acad Sci U S A       Date:  2021-02-02       Impact factor: 11.205

8.  Modeling the instantaneous normal mode spectra of liquids as that of unstable elastic media.

Authors:  Walter Schirmacher; Taras Bryk; Giancarlo Ruocco
Journal:  Proc Natl Acad Sci U S A       Date:  2022-02-22       Impact factor: 11.205

9.  Energy Landscape of State-Specific Electronic Structure Theory.

Authors:  Hugh G A Burton
Journal:  J Chem Theory Comput       Date:  2022-02-18       Impact factor: 6.578

10.  Revisiting the concept of activation in supercooled liquids.

Authors:  Marco Baity-Jesi; Giulio Biroli; David R Reichman
Journal:  Eur Phys J E Soft Matter       Date:  2021-06-14       Impact factor: 1.890

  10 in total

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