In this contribution, we investigate the fundamental mechanism of plasticity in a model two-dimensional network glass. The glass is generated by using a Monte Carlo bond-switching algorithm and subjected to athermal simple shear deformation, followed by subsequent unloading at selected deformation states. This enables us to investigate the topological origin of reversible and irreversible atomic-scale rearrangements. It is shown that some events that are triggered during loading recover during unloading, while some do not. Thus, two kinds of elementary plastic events are observed, which can be linked to the network topology of the model glass.
First Order Reversal Curves (FORCs) have been used for a number of years for the extraction of information from magnetization measurements. The results are most unambiguous for irreversible processes -- for a collection of Preisach hysterons, one gets a "FORC distribution" $ρ(H_{down},H_{up})$, the number of hysterons with given downward \& upward reversal fields. There have been many proposals for dealing with reversible behavior, usually involving inserting it somehow into the irreversible FORC distribution. Here we will try to do the opposite, to separate them into another function which we…
A unified thermodynamic framework for characterization of functional materials is developed. This framework encompasses linear reversible and irreversible processes with thermal, electrical, magnetic, and/or mechanical effects coupled. The comprehensive framework combines the principles of classical equilibrium and non-equilibrium thermodynamics with electrodynamics of continua in the infinitesimal strain regime. In the first part of this paper, linear Thermo-Electro-Magneto-Mechanical (TEMM) quasistatic processes are characterized. Thermodynamic stability conditions are further imposed on the…
Energy density limitations of layered oxides with different Ni contents, i.e., of the conventional cathode materials in Li-ion batteries, are investigated across the first discharge cycle using advanced spectroscopy and state-of-the-art diffraction. For the first time unambiguous experimental evidence is provided, that redox reactions in NCMs proceed via a reversible oxidation of Ni and a hybridization with O, and not, as widely assumed, via pure cationic or more recently discussed, pure anionic redox processes. Once Ni-O hybrid states are formed, the sites cannot be further oxidized. Instead,…
We study the stress fluctuations in simulations of a two-dimensional amorphous solid under a cyclic drive. It is known that this system organizes into a reversible state for small driving amplitudes and remains in an irreversible state for high driving amplitudes, and that a critical driving amplitude separates the two regimes. Here we study the time series of the stress fluctuations below and above the reversible-irreversible transition. In the irreversible regime above the transition, the power spectrum of the stress fluctuations is broad and has a $1/f^α$ shape with $1< α<2$. We find that t…
In conventional FORC (First Order Reversal Curve) analysis of a magnetic system, reversible and low-coercivity irreversible materials are treated as being qualitatively different: the FORC distribution shows low-coercivity materials but completely hides reversible (zero-coercivity) ones. This distinction is artificial -- as the coercivity approaches zero, the physical properties of an irreversible material change smoothly into those of a reversible material. We have developed a method (called FORC+, implemented in free software at http://MagVis.org) for displaying the reversible properties of …
The effect of oscillatory shear strain on nonaffine rearrangements of individual particles in a three-dimensional binary glass is investigated using molecular dynamics simulations. The amorphous material is represented by the Kob-Andersen mixture at the temperature well below the glass transition. We find that during periodic shear deformation of the material, some particles undergo reversible nonaffine displacements with amplitudes that are approximately power-law distributed. Our simulations show that particles with large amplitudes of nonaffine displacement exhibit a collective behavior; na…
Manganese oxides have received much attention over the years among the wide range of electrocatalysts for the oxygen evolution reaction (OER) due to their low toxicity, high abundance and rich redox chemistry. While many previous studies focused on the activity of these materials, a better understanding of the material transformations relating to activation or degradation is highly desirable, both from a scientific perspective and for applications. We electrodeposited Na-containing MnOx without long-range order from an alkaline solution to investigate these aspects by cyclic voltammetry, scann…
