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  • articleNo Access

    Influence of Structural Configurations, Boundary Conditions, and Atomic Number on the Curie Transition Temperature of Bulk Cobalt: A Monte Carlo Simulation Study

    Nano13 Jan 2025

    This study investigates the impact of structural configurations, boundary conditions, and atomic number on the Curie transition temperature (Tc) of bulk cobalt (Co) utilizing Monte Carlo simulations. The analysis reveals that the Curie temperature increases as the structure transitions from a simple cubic (SC) to a body-centered cubic (BCC), hexagonal close-packed (HCP), and face-centered cubic (FCC) configuration. The SC structure, exhibiting the lowest Tc, serves as the reference for evaluating these influencing factors. The study also demonstrates that nonperiodic boundary conditions yield the lowest Tc compared to periodic ones. Additionally, an increase in the number of atoms from 4000 to 108,000 under nonperiodic boundary conditions correlates with an increase in Tc. These findings are consistent with experimental data and provide a foundational basis for researchers involved in the synthesis and application of bulk Co in devices, biomedical applications at room temperature, and emerging technologies.

  • articleNo Access

    Effect of heating rate, impurity concentration of Cu, atomic number, temperatures, time annealing temperature on the structure, crystallization temperature and crystallization process of Ni1xCux bulk; x = 0.1, 0.3, 0.5, 0.7

    This paper studies the effects of heating rate 4 × 1011 K/s, 4 × 1012 K/s, 4 × 1013 K/s; impurity concentration of Cu on Ni1xCux bulk with x = 0.1, x = 0.3, x = 0.5, x = 0.7; atom number (N), N = 4000 atoms, 5324 atoms, 6912 atoms, 8788 atoms at temperatures (T), T = 300 K; N = 6912 atoms at T = 300 K, 400 K, 500 K, 600 K, 700 K, 800 K; N = 6912 atoms at T = 600 K after time annealing temperature (t), t = 500 ps on the structure, crystallization temperature and crystallization process of Ni1xCux bulk by molecular dynamics (MD) method with interactive embedding Sutton–Chen (ST) and periodic boundary conditions. The structural characteristics were analyzed through radial distribution function (RDF), energy total (Etot), size (l) and common neighborhood analysis (CNA) method; temperature (T), crystallization temperature (Tg), crystallization process through relationship between Etot, T. The results showed Ni1xCux bulk and links Ni–Ni, Ni–Cu, Cu–Cu always exist in 03 types structures: FCC, HCP, Amor. When time annealing temperature increases then Ni1xCux bulk moves from a crystalline state to an amorphous state. When increases impurity concentration of Cu in Ni1xCux bulk, then the structure unit number FCC, HCP decreases and then increases, structure unit number Amor increases and then decreases. When atom number (N) increases, decreasing T and increasing time annealing temperature lead to structure unit number FCC, HCP increases, Amor decreases and structural, crystallization temperature, crystallization process of Ni1xCux bulk change.

  • articleNo Access

    FURTHER STUDIES OF SOME TL CHARACTERISTICS OF MgB4O7:Dy, Na PHOSPHOR

    Nowadays, the pacific use of ionizing radiation has attracted a great deal of attention in medicine, as well as in radiodiagnostic, and radiotherapy. However to avoid unnecessary irradiations to the healthy tissue, a strict quality control is required. This has led to the development of a new dosimeter equivalent to the tissue that could be highly suitable for the radiation dosimetry. The borate of magnesium with its low effective atomic number (Zeff), is considered equivalent to the human-tissue. For this reason, in this work, we present the results obtained of the thermoluminescent characterization of this material. The test that was carried out includes the lower detection limit, sensitivity, reproducibility of the TL measurement, stability of information (fading), and TL response as a function of the delivered dose and energy response, which are recommended by the International Commission on Radiological Units and Measurements (ICRU) and International Commission on Radiological Protection (ICRP). Two different concentrations of Dy activator were used i.e. 1.25 (batch A) and 1.5 (batch B) mol%. Meanwhile, the Na activator was 0.5 mol% in both cases. The results show that this new thermoluminescent material is adequate for radiation dosimetry in different medical applications.

  • articleNo Access

    Empirical formula for electron capture half-lives

    In this study, efforts were made to propose a semi-empirical equation for electron capture within the atomic number range 7Z103 and the mass number range of 12A252. About 753 nuclei were considered for the same. These nuclei were categorized into four groups based on the parities of both protons and neutrons: even(Z)–even(N), even(Z)–odd(N), odd(Z)–even(N) and odd(Z)–odd(N). Comparative analysis was carried out between the formula’s predictions and experimental data. The improved semi-empirical formula for electron capture belongs to the first category, requiring only the daughter nucleus’s atomic number and decay energy, making them a valuable tool for predicting electron capture half-lives. The present formula effectively describes even-Z-even-N cases. However, significant discrepancies occur when either Z or N is odd in nuclei, indicating that further refinement is necessary to improve.

  • articleNo Access

    FORMULAE FOR MAXIMUM ESCAPE DEPTH OF REDIFFUSED ELECTRONS AND BACKSCATTERING COEFFICIENT OF METAL FILMS

    Based on the experimental maximum escape depth S(Wp0, Z) of rediffused electrons from atomic number Z metal at incident energy of primary electron Wp0, the relationship among S(Wp0, Z), Wp0 and Z in the energy range of 9.3keVWp040keV was obtained and proved to be true by experimental data. According to the experimental results of rediffused electrons, the characteristics of secondary electron emission, relationships among parameters of rediffused electrons and the main processes of rediffused electrons emission, the formula for Wp0 backscattering coefficient η(Wp0, Z, t) of Z metal films with film thickness t as a function of t, Z and was deduced, and the results were analyzed. It is concluded that the deduced formula for η(Wp0, Z, t) can be used to calculate η(Wp0, Z, t) in the energy range of 9.3keVWp040keV. The secondary electron yield δ from thin films are applied in more and more fields such as electronic information technology, accelerator and space flight, and η(Wp0, Z, t) is an important parameter of δ from Z metal films. So deducing the formula for η(Wp0, Z, t) in this study is necessary.

  • chapterNo Access

    1: Introduction

      Some people think that carbon and sustainable development are not compatible. This textbook shows that carbon dioxide (CO2) from the air and bio-carbon from biomass are our best allies in the energy transition, towards greater sustainability. We pose the problem of the decarbonation (or decarbonization) of our economy by looking at ways to reduce our dependence on fossil carbon (coal, petroleum, natural gas, bitumen, carbonaceous shales, lignite, peat). The urgent goal is to curb the exponential increase in the concentration of carbon dioxide in the atmosphere and hydrosphere (Figures 1.1 and 1.2) that is directly related to our consumption of fossil carbon for our energy and materials The goal of the Paris agreement (United Nations COP 21, Dec. 12, 2015) of limiting the temperature increase to 1.5 degrees (compared to the pre-industrial era, before 1800) is becoming increasingly unattainable (Intergovermental Panel on Climate Change (IPCC), report of Aug. 6, 2021). On Aug. 9, 2021 Boris Johnson, prime minister of the United Kingdom, declared that coal needs to be consigned to history to limit global warming. CO2 has an important social cost…