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Most methods for estimating configurational entropy from molecular simulation data yield upper limits except for harmonic systems where they are exact. Problems arise at diffusive systems and the presence of conformational transitions.…

化学物理 · 物理学 2019-10-22 Jürgen Schlitter , Matthias Massarczyk

Entropy governs molecular self-assembly, phase transitions, and material stability, yet remains challenging to quantify and directly control in molecular systems. Here, we demonstrate that the computable information density (CID), a data…

统计力学 · 物理学 2026-02-27 Ashley Z. Guo , Kaelyn Chang , Nicholas J. Corrente

Accurate calculations of strongly correlated materials remain a formidable challenge in condensed matter physics, particularly due to the computational demand of conventional methods. This paper presents an efficient solver for dynamical…

强关联电子 · 物理学 2025-12-04 Basile Herzog , Patrik Thunström , Olle Eriksson

We consider tachyonic braneworld with a bulk cosmological constant and investigate a configurational entropy of various magnitudes of scale factor. It is found that for a bulk negative/zero cosmological constant, the configurational entropy…

高能物理 - 理论 · 物理学 2019-10-30 Chong Oh Lee

We investigate a system described by two real scalar fields coupled with gravity in (4, 1) dimensions in warped spacetime involving one extra dimension. The results show that the parameter which controls the way the two scalar fields…

高能物理 - 理论 · 物理学 2009-11-10 D. Bazeia , A. R. Gomes

A simple second quantization model is used to describe a two-mode Bose-Einstein condensate (BEC), which can be written in terms of the generators of a SU(2) algebra with three parameters. We study the behaviour of the entanglement entropy…

量子气体 · 物理学 2013-08-02 Citlali Perez Campos , Jose R. Gonzalez Alonso , Octavio Castanos , Ramon Lopez

Electromagnetic transitions involving nucleons and their resonances are here presented in the fermionic sector of the AdS/QCD soft-wall model, using the differential configurational entropy (DCE) as a measure of information entropy. The DCE…

高能物理 - 理论 · 物理学 2023-05-18 Roldao da Rocha

We demonstrate that configurational electronic entropy, previously neglected, in {\it ab initio} thermodynamics of materials can qualitatively modify the finite-temperature phase stability of mixed-valence oxides. While transformations from…

材料科学 · 物理学 2015-11-17 Fei Zhou , Thomas Maxisch , Gerbrand Ceder

We systematically extend the statement that the configurational entropy provides an alternative approach to studying gravitational stability of compact objects, carried out in the previous work of M. Gleiser and N. Jiang, Phys. Rev. D {\bf…

广义相对论与量子宇宙学 · 物理学 2023-03-20 P. S. Koliogiannis , G. A. Tsalis , C. P. Panos , Ch. C. Moustakidis

We show that a newly proposed Shannon-like entropic measure of shape complexity applicable to spatially-localized or periodic mathematical functions known as configurational entropy (CE) can be used as a predictor of spontaneous decay rates…

原子物理 · 物理学 2018-03-26 Marcelo Gleiser , Nan Jiang

Computer simulations have been employed in recent years to evaluate the configurational entropy changes in model glass-forming liquids. We consider two methods, both of which involve the calculation of the `intra-basin' entropy as a means…

统计力学 · 物理学 2009-10-31 Srikanth Sastry

We calculate the evolution of the geometric entanglement entropy following a local quench in the D1D5 conformal field theory, a two-dimensional theory that describes a particular bound state of D1 and D5 branes. The quench corresponds to a…

高能物理 - 理论 · 物理学 2015-03-19 Curtis T. Asplund , Steven G. Avery

This paper applies Benders decomposition to two-stage stochastic problems for energy planning under climate uncertainty, a key problem for the design of renewable energy systems. To improve performance, we adapt various refinements for…

最优化与控制 · 数学 2024-01-29 Leonard Göke , Felix Schmidt , Mario Kendziorski

The field of high entropy oxides (HEOs) flips traditional materials science paradigms on their head by seeking to understand what properties arise in the presence of profound configurational disorder. This disorder, which originates from…

材料科学 · 物理学 2024-10-30 Solveig S. Aamlid , Mohamed Oudah , Jörg Rottler , Alannah M. Hallas

Transfer entropy (TE) is an information theoretic measure that reveals the directional flow of information between processes, providing valuable insights for a wide range of real-world applications. This work proposes Transfer Entropy…

信息论 · 计算机科学 2025-07-22 Omer Luxembourg , Dor Tsur , Haim Permuter

High entropy alloys (HEAs) have been increasingly attractive as promising next-generation materials due to their various excellent properties. It's necessary to essentially characterize the degree of chemical ordering and identify…

材料科学 · 物理学 2019-08-13 Jiaxin Zhang , Xianglin Liu , Sirui Bi , Junqi Yin , Guannan Zhang , Markus Eisenbach

We propose new braneworld models arising from a scalar field in the bulk. In these examples, the induced on--brane line element is de Sitter (or anti de Sitter) and the bulk (five dimensional) Einstein equations can be exactly solved to…

高能物理 - 理论 · 物理学 2009-05-05 Supratik Pal , Sayan Kar

Multi-sector capacity expansion models play a crucial role in energy planning by providing decision support for policymaking in technology development. To ensure reliable support, these models require high technological, spatial, and…

最优化与控制 · 数学 2025-04-14 Federico Parolin , Yu Weng , Paolo Colbertaldo , Ruaridh Macdonald

The configurational entropy of several H-disordered ice polymorphs is calculated by means of a thermodynamic integration along a path between a totally H-disordered state and one fulfilling the Bernal-Fowler ice rules. A Monte Carlo…

化学物理 · 物理学 2014-06-24 Carlos P. Herrero , Rafael Ramirez

Bose-Einstein condensates (BECs) offer the potential to examine quantum behavior at large length and time scales, as well as forming promising candidates for quantum technology applications. Thus, the manipulation of BECs using control…

量子物理 · 物理学 2016-05-25 David Hocker , Julia Yan , Herschel Rabitz