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Condensed Matter, Volume 7, Issue 4

2022 December - 21 articles

Cover Story: We employed robust machine learning interatomic potentials to explore the thermal expansion coefficients of suspended and supported carbon-based nanosheets. For the supported monolayers, the Lennard–Jones potential was employed to describe interactions between the considered monolayers and the substrate. Analyses of molecular dynamics trajectories reveal that the substrate can significantly reduce the formation of out-of-plane wrinkles and consequently affect the thermal expansion coefficients of 2D materials. The obtained results provide a useful vision of the role of the substrate in the complex thermal expansion responses of 2D materials. View this paper
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Articles (21)

  • Article
  • Open Access
2,541 Views
13 Pages

We report the ground state stabilization and corresponding electrical transport and magnetotransport properties of a 2D metallic system with an isotropic Fermi surface reconstructed by a charge density wave. The onset of the charge density wave is a...

  • Review
  • Open Access
4 Citations
4,202 Views
16 Pages

Progress and Perspectives of Spectroscopic Studies on Carbon K-Edge Using Novel Soft X-ray Pulsed Sources

  • Zeinab Ebrahimpour,
  • Marcello Coreno,
  • Luca Giannessi,
  • Massimo Ferrario,
  • Augusto Marcelli,
  • Federico Nguyen,
  • Seyed Javad Rezvani,
  • Francesco Stellato and
  • Fabio Villa

The development of novel coherent and brilliant sources, such as soft X-ray free electron laser (FEL) and high harmonic generation (HHG), enables new ultrafast analysis of the electronic and structural dynamics of a wide variety of materials. Soft X-...

  • Article
  • Open Access
11 Citations
3,322 Views
11 Pages

This research synthesised zinc oxide (ZnO) structure by a hydrothermal method. ZnO samples were prepared using different molarities of zinc (Zn) precursor, ranging from 0.10 to 0.16 M. Structural and morphological properties were characterised by X-r...

  • Article
  • Open Access
15 Citations
4,686 Views
20 Pages

Systematic Trends in Hybrid-DFT Computations of BaTiO3/SrTiO3, PbTiO3/SrTiO3 and PbZrO3/SrZrO3 (001) Hetero Structures

  • Roberts I. Eglitis,
  • Sergei Piskunov,
  • Anatoli I. Popov,
  • Juris Purans,
  • Dmitry Bocharov and
  • Ran Jia

We performed predictive hybrid-DFT computations for PbTiO3, BaTiO3, SrTiO3, PbZrO3 and SrZrO3 (001) surfaces, as well as their BaTiO3/SrTiO3, PbTiO3/SrTiO3 and PbZrO3/SrZrO3 (001) heterostructures. According to our hybrid-DFT computations for BO2 and...

  • Article
  • Open Access
4 Citations
3,060 Views
20 Pages

Physicochemical Properties of Ti3+ Self-Doped TiO2 Loaded on Recycled Fly-Ash Based Zeolites for Degradation of Methyl Orange

  • Iván Supelano García,
  • Carlos Andrés Palacio Gómez,
  • Marc H. Weber,
  • Indry Milena Saavedra Gaona,
  • Claudia Patricia Castañeda Martínez,
  • José Jobanny Martínez Zambrano,
  • Hugo Alfonso Rojas Sarmiento,
  • Julian Andrés Munevar Cagigas,
  • Marcos A. Avila and
  • Julieth Alexandra Mejía Gómez
  • + 2 authors

The extensive production of coal fly ash by coal combustion is an issue of concern due to its environmental impact. TiO2-zeolite composites were synthesized, at low cost, using recycled coal fly ash from a local thermoelectric power plant to produce...

  • Feature Paper
  • Article
  • Open Access
10 Citations
2,696 Views
12 Pages

Polarons in Rock-Forming Minerals: Physical Implications

  • Boriana Mihailova,
  • Giancarlo Della Ventura,
  • Naemi Waeselmann,
  • Simone Bernardini,
  • Wei Xu and
  • Augusto Marcelli

The existence of thermally-activated quasiparticles in amphiboles is an important issue, as amphiboles are among the main hydrous complex silicate minerals in the Earth’s lithosphere. The amphibole structure consists of stripes of 6-membered TO...

  • Communication
  • Open Access
4 Citations
2,967 Views
6 Pages

The thermal expansion coefficient (TEC) of suspended two-dimensional (2D) nanomaterials is usually negative due to their ability for large out-of-plane deflection as the temperature increases. The presence of a substrate can nonetheless restrict the...

  • Feature Paper
  • Article
  • Open Access
2 Citations
2,864 Views
19 Pages

This paper reports the computational study of phosphorus-doped boron clusters PBn/PBn/PBn+ (n = 4–8). First, a global search and optimization of these clusters were performed to determine the stable structures. We used density functional...

  • Article
  • Open Access
4 Citations
2,767 Views
10 Pages

The experimental discovery that compressed sulfur hydride exhibits superconducting transition temperature of Tc=203 K by Drozdov et al. (Nature 2015, 525, 73–76) sparked studies of compressed hydrides. This discovery was not a straigh...

  • Article
  • Open Access
3 Citations
2,531 Views
4 Pages

A simple explanation is given for the linear dependence of electrical resistance on temperature and the linear dependence of the magnetoresistance on the magnetic field in high-temperature superconducting cuprates, which has been mysterious for many...

  • Article
  • Open Access
14 Citations
3,644 Views
11 Pages

In this report, we discuss the preparation of undoped and (Fe,Co) co-doped ZnO nanocomposites via an ultrasonicated probe, which were both under UV irradiation for 12 h and annealed at 400 °C for four hours in ambient air. Here, we investigated t...

  • Article
  • Open Access
2 Citations
2,093 Views
17 Pages

In this work, we investigate the collective role of thermal and quantum fluctuations on non-equilibrium thermodynamics of a quantum system, specifically, the quantum-thermodynamic description of spin-1 nuclei based on the concepts of quantum and stat...

  • Article
  • Open Access
3 Citations
2,742 Views
14 Pages

The development of a wide-range phenomenological model of metal with a small number of adjustable parameters for studying the behavior of metals in expanded and compressed states under the exposition of high energy density fluxes is the objective of...

  • Article
  • Open Access
3 Citations
2,205 Views
8 Pages

Breakdown of Adiabatic Superconductivity in Ca-Doped h-BN Monolayer

  • Ewa A. Drzazga-Szczȩśniak,
  • Dominik Szczȩśniak,
  • Adam Z. Kaczmarek and
  • Radosław Szczȩśniak

In the present paper, we report the breakdown of the adiabatic picture of superconductivity in a calcium-doped hexagonal boron nitride (Ca-h-BN) monolayer and discuss its implications for the selected properties of this phase. In particular, it is sh...

  • Article
  • Open Access
2,239 Views
12 Pages

Rabi Coupled Fermions in the BCS–BEC Crossover

  • Luca Dell’Anna,
  • Federico De Bettin and
  • Luca Salasnich

We investigate the three-dimensional BCS–BEC crossover in the presence of a Rabi coupling, which strongly affects several properties of the system, such as the chemical potential, the pairing gap and the superfluid density. We determine the cri...

  • Article
  • Open Access
1,716 Views
9 Pages

Low-temperature dielectric properties of charge/orbital-ordered manganite, Pr1−xCaxMnO3 for 0.40 ≤ x ≤ 0.50, was investigated systematically as a function of Ca content, x. The Ca content dependence of dielectric permittivity and dissipat...

  • Article
  • Open Access
4 Citations
2,581 Views
12 Pages

We have studied the superexchange interaction Jij in doped 2D cuprates. The AFM interaction strongly depends on the state of the lattice of a CuO2 layer surrounded by two LaO rock salt layers. In a static U and D stripe nanostructure, the homogeneous...

  • Article
  • Open Access
6 Citations
2,537 Views
10 Pages

Scale-Free Distribution of Oxygen Interstitial Wires in Optimum-Doped HgBa2CuO4+y

  • Gaetano Campi,
  • Maria Vittoria Mazziotti,
  • Thomas Jarlborg and
  • Antonio Bianconi

Novel nanoscale probes are opening new venues for understanding unconventional electronic and magnetic functionalities driven by multiscale lattice complexity in doped high-temperature superconducting perovskites. In this work, we focus on the multis...

  • Article
  • Open Access
2 Citations
2,646 Views
9 Pages

Laser-Induced Magnetization Dynamics in Si-Doped Yttrium-Iron Garnet Film

  • Mikhail Gaponov,
  • Sergey Ovcharenko,
  • Nikita Ilyin and
  • Elena Mishina

We experimentally demonstrate that the excitation of a silicon-doped yttrium-iron garnet film by femtosecond laser pulses triggers a magnetization precession with an amplitude determined by the external magnetization direction. The maximum efficiency...

  • Article
  • Open Access
8 Citations
5,136 Views
9 Pages

First Principles Calculations of the Optical Response of LiNiO2

  • Veenavee Nipunika Kothalawala,
  • Assa Aravindh Sasikala Devi,
  • Johannes Nokelainen,
  • Matti Alatalo,
  • Bernardo Barbiellini,
  • Tao Hu,
  • Ulla Lassi,
  • Kosuke Suzuki,
  • Hiroshi Sakurai and
  • Arun Bansil

We discuss optical properties of layered Lithium Nickel oxide (LiNiO2), which is an attractive cathode material for realizing cobalt-free lithium-ion batteries, within the first-principles density functional theory (DFT) framework. Exchange correlati...

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Condens. Matter - ISSN 2410-3896