On the stability of nuclei against β-emission

1939 ◽  
Vol 35 (2) ◽  
pp. 242-255 ◽  
Author(s):  
K. Fuchs
Keyword(s):  
General Scheme ◽  
Light Nuclei ◽  
Charge Number ◽  
The Stability ◽  
Experimental Values ◽  
Good Agreement

By means of purely qualitative arguments which do not depend on any particular model, the general scheme of stable nuclei and the isotopic breadth of nuclei with odd charge number are explained.The breadth of the isobaric region can be obtained if the numerical values of certain energies are known. Though these can be estimated only very roughly, the values for the breadth of the isobaric region obtained in this way are in good agreement with the experimental values. The increase in the breadth of the isobaric region from light nuclei to heavier nuclei can be explained, but no plausible explanation has been found for the fact that the breadth decreases again for the heaviest nuclei.

Energetics and Structural Effects of Boron Additive to Intermetallic Compound: γ-Tial

1990 ◽  
Vol 213 ◽  
Author(s):  
P.K. Khowash ◽  
D.L. Price ◽  
B.R. Cooper
Keyword(s):  
Intermetallic Compound ◽  
Total Energy ◽  
Site Selection ◽  
Lattice Structure ◽  
Practical Importance ◽  
The Difference ◽  
The Stability ◽  
Experimental Values ◽  
And Behavior ◽  
Good Agreement

ABSTRACTImproving the low temperature ductility of the intermetallic compound γ - TiAl by alloying with small concentrations of an additive is of great practical importance. The difference in site selection energy of the additive plays an important role in the stability and behavior of the alloy. For boron in L10 TiAl, we have calculated the site selection energy using linearized combination of muffin-tin orbitals (LMTO) total energy calculations. For pure γ - TiAl, we found the equilibrium lattice structure by minimizing the total energy, and obtained good agreement with the experimental values. With the introduction of boron, a relaxation of the lattice around the boron additive is expected. For boron additives, we have calculated the forces on each atom leading to the minimization of the total energy as a function of the ionic positions in order to obtain the “true” stable structure of the alloy.

Lattice-Dynamical Estimation of Atomic Displacement Parameters in Carbonates: Calcite and Aragonite CaCO3, Dolomite CaMg(CO3)2 and Magnesite MgCO3

1998 ◽  
Vol 54 (5) ◽  
pp. 515-523 ◽  
Author(s):  
T. Pilati ◽  
F. Demartin ◽  
C. M. Gramaccioli
Keyword(s):  
Structure Refinement ◽  
Atomic Displacement ◽  
Empirical Potentials ◽  
Wide Range ◽  
Anisotropic Displacement Parameters ◽  
The Stability ◽  
Experimental Values ◽  
Atomic Displacement Parameters ◽  
Good Agreement ◽  
Raman And Ir Spectra

Using crystallographic information and empirical potentials derived from fitting the vibrational frequencies of all the substances under study, together with those of a group of silicates and oxides, a Born–von Karman rigid-ion lattice-dynamical model has been applied to the whole Brillouin zone in calcite, aragonite (α- and β-CaCO3, respectively), magnesite (MgCO3) and dolomite [CaMg(CO3)2]. The Raman and IR spectra are satisfactorily reproduced and interpreted by these calculations; there is also very good agreement with atomic anisotropic displacement parameters (a.d.p.'s) derived from accurate crystal structure refinement by various authors and with the experimental values of thermodynamic functions over a wide range of temperatures. On these vibrational grounds, the stability of calcite with respect to aragonite at high temperature can be accounted for.

Modeling of Temperature in Orthopaedic Drilling Using Fuzzy Logic

2012 ◽  
Vol 249-250 ◽  
pp. 1313-1318 ◽  
Author(s):  
Rupesh Kumar Pandey ◽  
S.S. Panda
Keyword(s):  
Plastic Deformation ◽  
Fuzzy Logic ◽  
Orthopaedic Surgery ◽  
Fuzzy Model ◽  
Bone Drilling ◽  
Common Procedure ◽  
Screw Insertion ◽  
The Stability ◽  
Experimental Values ◽  
Good Agreement

Bone drilling is a common procedure to produce hole for screw insertion to fixate the fracture devices and implants during orthopaedic surgery. A major problem which is encountered during such a procedure is the increase in temperature of the bone due to the plastic deformation of chips and the friction between the bone and drill. This increase in temperature can result in thermal osteonecrosis which may delay healing or reduce the stability and strength of the fixation. In the present work, prediction of temperature in drilling of polymethylmethacrylate (PMMA) (as a substitute for bone) is carried out using fuzzy logic. The effectiveness of the fuzzy model is compared with the experimental results. Good agreement is observed between the predictive model values and experimental values which indicates that that the developed model can be effectively used to determine the temperature in the bone drilling.

The Relationship between Viscosity and Electrical Conductivity of CaF2-SiO2-Al2O3-CaO-MgO Slag System

2012 ◽  
Vol 724 ◽  
pp. 460-463 ◽  
Author(s):  
Jian Tao Ju ◽  
Zhen Lin Lu ◽  
Zhi Yuan Jiao ◽  
Jun Yang ◽  
Zhao Hui Zhang
Keyword(s):  
Electrical Conductivity ◽  
Slag System ◽  
Regression Method ◽  
Slag Viscosity ◽  
Refining Slag ◽  
The Stability ◽  
Experimental Values ◽  
The Relationship ◽  
Good Agreement ◽  
Calculating Model

The relationship between the viscosity and the electrical conductivity of CaF2-SiO2- Al2O3-CaO-MgO slag system was deduced through theoretical calculation and experiment. The experiment was designed by quadratic orthogonal rotary regression method. The slag viscosity and conductivity were measured at 1600, and the constant (C) was calculated. The calculating model between each component mass fraction and constant C was performed, and the stability of calculating model was also verified by representative slag. The results showed that the calculating constant (C) of regression model is in good agreement with experimental values. Thus, the relationship between refining slag viscosity and conductivity using the formula at certain temperature is feasible.

scholarly journals Prediction of stability constants of Cu2+ complexes with organic fluorescent ligands using thermodynamic cycle in combination with DFT theory and SMD solvent model

2020 ◽  
Vol 129 (1D) ◽  
pp. 15-23
Author(s):  
Mai Van Bay ◽  
Nguyen Khoa Hien ◽  
Hoang Kim Thanh ◽  
Pham Cam Nam ◽  
Duong Tuan Quang
Keyword(s):  
Stability Constants ◽  
Thermodynamic Cycle ◽  
Fluorescent Sensors ◽  
Solvent Model ◽  
Fluorescent Ligands ◽  
The Stability ◽  
Experimental Values ◽  
Calcein Blue ◽  
Important Basis ◽  
Good Agreement

Accurately predicting the stability constant ( ) of the Cu2+ complex with organic fluorescent ligands provides an important basis to design molecular fluorescent sensors for selective detection of Cu2+. With appropriate reference complexes, the calculated stability constants are in good agreement with experimental values. The  values of the predicted stability constants of Cu2+ complexes with Calcein blue (H3Cb) and FluoZin-1 (H2Fz) are 13.33 (exp. 14.27) and 6.59 (exp. 6.01), respectively. More importantly, the results could be applied to the investigation of complexes.

scholarly journals Solubility Data of Potential Salts in the MgO-CaO-SO2-H2O-O2 System for Process Modeling

Processes ◽  
2020 ◽  
Vol 9 (1) ◽  
pp. 50
Author(s):  
Barbara D. Weiß ◽  
Michael Harasek
Keyword(s):  
Process Modeling ◽  
Ph Value ◽  
Process Models ◽  
Solubility Data ◽  
Solid Base ◽  
International Union ◽  
The Stability ◽  
Experimental Values ◽  
So2 Absorption ◽  
Reliable Basis

This review studies unwanted precipitation reactions, which can occur in SO2 absorption processes using a magnesium hydroxide slurry. Solubility data of potential salts in the MgO-CaO-SO2-H2O system are evaluated. The reviewed data can serve as a reliable basis for process modeling of this system used to support the optimization of the SO2 absorption process. This study includes the solubility data of MgSO3, MgSO4, Mg(OH)2, CaSO3, CaSO4, and Ca(OH)2 as potential salts. The solubility is strongly dependent on the state of the precipitated salts. Therefore, this review includes studies on the stability of different forms of the salts under different conditions. The solubility data in water over temperature serve as a base for modeling the precipitation in such system. Furthermore, influencing factors such as pH value, SO2 content and the co-existence of other salts are included and available data on such dependencies are reviewed. Literature data evaluated by the International Union of Pure and Applied Chemistry (IUPAC) are revisited and additional and newer studies are supplemented to obtain a solid base of accurate experimental values. For temperatures higher than 100 °C the available data are scarce. For a temperature range from 0 to 100 °C, the reviewed investigations and data provide a good base to evaluate and adapt process models for processes in order to map precipitations issues accurately.

Systematic calculations of energy levels and transitions rates in Mo XXVIII

2020 ◽  
Vol 75 (8) ◽  
pp. 739-747
Author(s):  
Feng Hu ◽  
Yan Sun ◽  
Maofei Mei
Keyword(s):  
Energy Levels ◽  
Oscillator Strengths ◽  
Atomic Data ◽  
Data Sets ◽  
Electron Systems ◽  
Excitation Energies ◽  
Experimental Values ◽  
Qed Effects ◽  
Hyperfine Structures ◽  
Good Agreement

AbstractComplete and consistent atomic data, including excitation energies, lifetimes, wavelengths, hyperfine structures, Landé gJ-factors and E1, E2, M1, and M2 line strengths, oscillator strengths, transitions rates are reported for the low-lying 41 levels of Mo XXVIII, belonging to the n = 3 states (1s22s22p6)3s23p3, 3s3p4, and 3s23p23d. High-accuracy calculations have been performed as benchmarks in the request for accurate treatments of relativity, electron correlation, and quantum electrodynamic (QED) effects in multi-valence-electron systems. Comparisons are made between the present two data sets, as well as with the experimental results and the experimentally compiled energy values of the National Institute for Standards and Technology wherever available. The calculated values including core-valence correction are found to be in a good agreement with other theoretical and experimental values. The present results are accurate enough for identification and deblending of emission lines involving the n = 3 levels, and are also useful for modeling and diagnosing plasmas.

OPTIMAL VELOCITY MODEL WITH RELATIVE VELOCITY

2006 ◽  
Vol 17 (01) ◽  
pp. 65-73 ◽  
Author(s):  
SHIRO SAWADA
Keyword(s):  
Nonlinear Analysis ◽  
Relative Velocity ◽  
Velocity Model ◽  
Fundamental Diagram ◽  
Optimal Velocity ◽  
Traffic Jam ◽  
Optimal Velocity Model ◽  
Linear And Nonlinear ◽  
The Stability ◽  
Good Agreement

The optimal velocity model which depends not only on the headway but also on the relative velocity is analyzed in detail. We investigate the effect of considering the relative velocity based on the linear and nonlinear analysis of the model. The linear stability analysis shows that the improvement in the stability of the traffic flow is obtained by taking into account the relative velocity. From the nonlinear analysis, the relative velocity dependence of the propagating kink solution for traffic jam is obtained. The relation between the headway and the velocity and the fundamental diagram are examined by numerical simulation. We find that the results by the linear and nonlinear analysis of the model are in good agreement with the numerical results.

scholarly journals DFT calculation and assignment of vibrational spectra of aryl and alkyl chlorophosphates

2014 ◽  
Vol 12 (2) ◽  
pp. 153-163
Author(s):  
Viktor Anishchenko ◽  
Vladimir Rybachenko ◽  
Konstantin Chotiy ◽  
Andrey Redko
Keyword(s):  
Vibrational Spectra ◽  
Basis Sets ◽  
Heavy Atoms ◽  
Wide Range ◽  
Complete Assignment ◽  
Key Factor ◽  
Polarization Functions ◽  
Experimental Values ◽  
Semi Empirical ◽  
Good Agreement

AbstractDFT calculations of vibrational spectra of chlorophosphates using wide range of basis sets and hybrid functionals were performed. Good agreement between calculated and experimental vibrational spectra was reached by the combination of non-empirical functional PBE0 with both middle and large basis sets. The frequencies of the stretching vibrations of the phosphate group calculated using semi-empirical functional B3LYP for all basis sets deviate significantly from the experimental values. The number of polarization functions on heavy atoms was shown to be a key factor for the calculation of vibrational frequencies of organophosphates. The importance of consideration of all the stable rotamers for a complete assignment of fundamental modes was shown.

Global Stability Analysis of the Wake behind a Circular Cylinder Based on the POD-Chiba Method

2011 ◽  
Vol 137 ◽  
pp. 72-76
Author(s):  
Wei Zhang ◽  
Xian Wen ◽  
Yan Qun Jiang
Keyword(s):  
Stability Analysis ◽  
Circular Cylinder ◽  
Global Stability ◽  
Dimensional Model ◽  
Global Stability Analysis ◽  
The Stability ◽  
Low Dimensional ◽  
Proper Orthogonal ◽  
Calculated Amount ◽  
Good Agreement

A proper orthogonal decomposition (POD) method is applied to study the global stability analysis for flow past a stationary circular cylinder. The flow database at Re=100 is obtained by CFD software, i.e. FLUENT, with which POD bases are constructed by a snapshot method. Based on the POD bases, a low-dimensional model is established for solving the two-dimensional incompressible NS equations. The stability of the flow solution is evaluated by a POD-Chiba method in the way of the eigensystem analysis for the velocity disturbance. The linear stability analysis shows that the first Hopf bifurcation takes place at Re=46.9, which is in good agreement with available results by other high-order accurate stability analysis methods. However, the calculated amount of POD is little, which shows the availability and advantage of the POD method.

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