AI Article Synopsis

  • Purely pairwise interactions, specifically soft repulsive forces followed by a hard-core interaction, lead to unique equilibrium structures unlike traditional sphere packing.
  • In low-temperature regions of the phase diagram, these interactions can cause a transition from a fluid state to a cluster crystal, where clusters display patterned orientations.
  • This study uses optimization methods and Monte Carlo simulations to explore two-dimensional cluster configurations, revealing a second phase transition from a disordered triangular dimer lattice at high temperatures to a nematic-oriented state with a centered-rectangular lattice at low temperatures.

Article Abstract

Purely pairwise interactions of the core-softened type, i.e., featuring a soft repulsion followed by a hard-core interaction at shorter distance, give rise to nontrivial equilibrium structures entirely different from the standard close packing of spheres. In particular, in a suitable low-temperature region of their phase diagram, such interactions are well known to favor a transition from a fluid to a cluster crystal. The residual mutual interaction between individual clusters can lead to the formation of patterns of their reciprocal orientations. In this work, we investigate two examples of such models in two dimensions, at the density most appropriate to the dimer phase, whereby clusters consist of just two particles, studying them with optimization techniques and Monte Carlo simulations. We focus on the dimer crystal, and unveil a second phase transition at extremely low temperature. This transition leads from a triangular dimer lattice with randomly disordered dimer orientations at high temperature to a reduced-symmetry ground state with nematic orientational order and a slightly distorted structure characterized by a centered-rectangular lattice at low temperature.

Download full-text PDF

Source
http://dx.doi.org/10.1103/PhysRevE.104.044602DOI Listing

Publication Analysis

Top Keywords

dimer phase
8
low temperature
8
dimer
5
low-temperature ordering
4
ordering dimer
4
phase
4
phase two-dimensional
4
two-dimensional model
4
model core-softened
4
core-softened particles
4

Similar Publications

Quantum magnetic materials can provide explicit realizations of paradigm models in quantum many-body physics. In this context, SrCu_{2}(BO_{3})_{2} is a faithful realization of the Shastry-Sutherland model for ideally frustrated spin dimers, even displaying several of its quantum magnetic phases as a function of pressure. We perform inelastic neutron scattering measurements on SrCu_{2}(BO_{3})_{2} at 5.

View Article and Find Full Text PDF

Safety and efficacy of intraoperative radiation therapy using a low-energy X-ray source for resectable pancreatic cancer: an interim evaluation of an ongoing prospective phase II study.

Cancer Biol Med

January 2025

Department of Pancreatic Cancer, Tianjin Medical University Cancer Institute & Hospital, National Clinical Research Center for Cancer, Key Laboratory of Cancer Prevention and Therapy, Tianjin, Tianjin's Clinical Research Center for Cancer, Tianjin 300060, China.

Objective: The role of intraoperative radiation therapy (IORT) in the management of resectable pancreatic cancer (RPC) remains unclear. To date, the application of IORT using a low-energy X-ray source has not been extensively investigated. Therefore, this study was conducted to evaluate the safety and efficacy of IORT using a 50 kV X-ray source in treating RPC.

View Article and Find Full Text PDF

Photoinduced hidden monoclinic metallic phase of VO driven by local nucleation.

Nat Commun

January 2025

State Key Laboratory of Superlattices and Microstructures, Institute of Semiconductors, Chinese Academy of Sciences, Beijing, China.

The insulator-to-metal transition in VO has garnered extensive attention for its potential applications in ultrafast switches, neuronal network architectures, and storage technologies. However, the photoinduced insulator-to-metal transition remains controversial, especially whether a complete structural transformation from the monoclinic to rutile phase is necessary. Here we employ the real-time time-dependent density functional theory to track the dynamic evolution of atomic and electronic structures in photoexcited VO, revealing the emergence of a long-lived monoclinic metal phase under low electronic excitation.

View Article and Find Full Text PDF

Background: This study aimed to assess the diagnosis of macrophage activation syndrome (MAS) at the onset of active childhood-onset systemic lupus erythematosus (cSLE), which is under-researched, and to compare the characteristics of cSLE with and without MAS, hypothesizing the existence of possible predictors of MAS in active cSLE.

Methods: This study enrolled 157 patients diagnosed with cSLE, with or without MAS, from Nanjing Medical University between January 2018 and May 2023. Data analysis was performed using an independent samples -test or the Mann-Whitney -test, the test, the Youden index to determine the optimal cutoff values for diagnosis, and binary logistic regression analysis to determine the predicted probability.

View Article and Find Full Text PDF

Mapping the local ambidextrous chirality in thin films of N phase by circular dichroism spectra.

Spectrochim Acta A Mol Biomol Spectrosc

December 2024

Department of Chemistry, University of Hull, Hull HU6 7RX, UK. Electronic address:

Circular dichroism mapping (CDM) method was introduced by utilizing the highly collimated light beam of synchrotron radiation (SR) available at Diamond Light Source B23 beamline for scanning the thin films of the N phase. We apply SR-CDM to two achiral dimeric materials exhibiting the N phase: symmetric DTC5C9 and dissymmetric DTC5C9CB. The SR-CDM measurements directly capture the chiral information in the local N domains, providing the ultimate complement to the theoretical predictions of the helical structures: the spontaneous symmetry breaking in N phase is ambidextrous.

View Article and Find Full Text PDF

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!