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This paper first establishes an approximate scaling property of the potential-energy function of a classical liquid with good isomorphs (a Roskilde-simple liquid). This "pseudohomogeneous" property makes explicit that - and in which sense -…

Soft Condensed Matter · Physics 2013-10-30 Jeppe C. Dyre

We derive exact results for the rate of change of thermodynamic quantities, in particular the configurational specific heat at constant volume, $C_V$, along configurational adiabats (curves of constant excess entropy $S_{\textrm{ex}}$).…

Statistical Mechanics · Physics 2014-08-06 Nicholas P. Bailey , Lasse Bøhling , Arno A. Veldhorst , Thomas B. Schrøder , Jeppe C. Dyre

This paper generalizes isomorph theory to systems that are not in thermal equilibrium. The systems are assumed to be R-simple, i.e., have a potential energy that as a function of all particle coordinates $\textbf{R}$ obeys the…

Soft Condensed Matter · Physics 2020-10-06 Jeppe C. Dyre

The isomorph theory provides an explanation for the so-called power law density scaling which has been observed in many molecular and polymeric glass formers, both experimentally and in simulations. Power law density scaling (relaxation…

Soft Condensed Matter · Physics 2014-08-11 Arno A. Veldhorst , Jeppe C. Dyre , Thomas B. Schrøder

Isomorphs are curves in the phase diagram along which a number of static and dynamic quantities are invariant in reduced units. A liquid has good isomorphs if and only if it is strongly correlating, i.e., the equilibrium virial/potential…

Soft Condensed Matter · Physics 2012-03-27 Trond S. Ingebrigtsen , Thomas B. Schrøder , Jeppe C. Dyre

Isomorphs are lines in the density-temperature plane of certain "strongly-correlating" or "Roskilde simple" liquids where two-point structure and dynamics have been shown to be close to identical up to a scale transformation. Here we…

Soft Condensed Matter · Physics 2013-12-25 Alex Malins , Jens Eggers , C. Patrick Royall

The previous paper [Veldhorst et al., J. Chem. Phys. 141, 054904 (2014)] demonstrated that the isomorph theory explains the scaling properties of a liquid of flexible chains consisting of ten Lennard-Jones particles connected by rigid…

Soft Condensed Matter · Physics 2017-01-04 Arno A. Veldhorst , Jeppe C. Dyre , Thomas B. Schrøder

The fundamental model of a periodic structure is a periodic point set up to rigid motion or isometry. Our recent paper in SoCG 2021 defined isometry invariants (density functions), which are complete in general position and continuous under…

Materials Science · Physics 2021-05-12 Daniel Widdowson , Marco Mosca , Angeles Pulido , Vitaliy Kurlin , Andrew I Cooper

The thermal and phase properties of a multifragmentation model which uses clusters as degrees of freedom, are explored as a function of isospin. A good qualitative agreement is found with the phase diagram of asymmetric nuclear matter as…

Nuclear Theory · Physics 2008-11-26 Ad. R. Raduta , F. Gulminelli

We describe a method to determine whether a material has isomorphs in its thermodynamic phase diagram. Isomorphs are state points for which various properties are invariant in reduced units. Such materials are commonly identified from…

Soft Condensed Matter · Physics 2017-09-13 D. Fragiadakis , C. M. Roland

This paper shows by computer simulations that some crystalline systems have curves in their thermodynamic phase diagrams, so-called isomorphs, along which structure and dynamics in reduced units are invariant to a good approximation. The…

Statistical Mechanics · Physics 2024-01-17 Dan E. Albrechtsen , Andreas E. Olsen , Ulf R. Pedersen , Thomas B. Schrøder , Jeppe C. Dyre

We simulate dynamic mechanical analysis experiments for the Kob-Andersen binary Lennard-Jones system. For this, the SLLOD algorithm with time-dependent strain rates is applied to give a sinusoidally varying strain at different densities and…

Disordered Systems and Neural Networks · Physics 2022-05-24 Kevin Moch , Nicholas P. Bailey

Isomorph theory is one of the promising theories to understand the quasi-universal relationship between thermodynamic, dynamic and structural characteristics. Based on the hidden scale invariance of the inverse power law potentials, it…

Statistical Mechanics · Physics 2019-07-31 Tae Jun Yoon , Min Young Ha , Emanuel A. Lazar , Won Bo Lee , Youn-Woo Lee

We show that for any liquid or solid with strong correlation between its $NVT$ virial and potential-energy equilibrium fluctuations, the temperature is a product of a function of excess entropy per particle and a function of density,…

Soft Condensed Matter · Physics 2012-03-13 Trond S. Ingebrigtsen , Lasse Bøhling , Thomas B. Schrøder , Jeppe C. Dyre

Isomorphs are curves in the thermodynamic phase diagram of invariant excess entropy, structure, and dynamics, while pseudoisomorphs are curves of invariant structure and dynamics, but not of the excess entropy. The latter curves have been…

Soft Condensed Matter · Physics 2024-10-30 Zahraa Sheydaafar , Jeppe C. Dyre , Thomas B. Schrøder

In the present article we carry out a molecular dynamics study of the core-softened system and show that the existence of the water-like anomalies in this system depends on the trajectory in $P-\rho-T$ space along which the behavior of the…

Soft Condensed Matter · Physics 2015-05-28 Yu. D. Fomin , V. N. Ryzhov , E. N. Tsiok

Polydisperse fluids are encountered everywhere in biological and industrial processes. These fluids naturally show a rich phenomenology exhibiting fractionation and shifts in critical point and freezing temperatures. Here, we study the…

Soft Condensed Matter · Physics 2015-09-07 Trond S. Ingebrigtsen , Hajime Tanaka

Isomorphs are curves in the thermodynamic phase diagram along which structure and dynamics are invariant to a good approximation. There are two main ways to trace out isomorphs, the configurational-adiabat method and the…

Soft Condensed Matter · Physics 2023-04-21 Zahraa Sheydaafar , Jeppe C. Dyre , Thomas B. Schrøder

Computer simulations show that liquids of molecules with harmonic intramolecular bonds may have "pseudoisomorphic" lines of approximately invariant dynamics in the thermodynamic phase diagram. We demonstrate that these lines can be…

Soft Condensed Matter · Physics 2016-12-30 Andreas Elmerdahl Olsen , Jeppe C. Dyre , Thomas B. Schrøder

Recent DFT (density functional theory) simulations showed that metals have a hitherto overlooked symmetry termed "hidden scale invariance" [Hummel {\em et al.}, Phys. Rev. B {\bf{92}}, 174116 (2015)]. According to isomorph theory, this…

Materials Science · Physics 2019-03-06 Laura Friedeheim , Jeppe C. Dyre , Nicholas P. Bailey
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