scholarly journals Effect of Charge Distribution in a Modified tRNA Substrate on Pre-Reaction Protein-tRNA Complex Geometry

ACS Omega ◽  
2021 ◽  
Vol 6 (6) ◽  
pp. 4227-4235
Author(s):  
Alexey Rayevsky ◽  
Mohsen Sharifi ◽  
Eugeniy Demianenko ◽  
Dmitriy Volochnyuk ◽  
Michael Tukalo
Keyword(s):  
Charge Distribution ◽  
Complex Geometry ◽  
Trna Substrate

Study of charge transfer in FeTi

1983 ◽  
Vol 41 ◽  
pp. 296-297
Author(s):  
J. Taft∅
Keyword(s):  
Charge Transfer ◽  
Charge Distribution ◽  
Electron Scattering ◽  
Periodic System ◽  
Electron Distribution ◽  
Scattering Amplitude ◽  
Transition Elements ◽  
Hartree Fock ◽  
Cscl Structure ◽  
The Right

It is well known that for reflections corresponding to large interplanar spacings (i.e., sin θ/λ small), the electron scattering amplitude, f, is sensitive to the ionicity and to the charge distribution around the atoms. We have used this in order to obtain information about the charge distribution in FeTi, which is a candidate for storage of hydrogen. Our goal is to study the changes in electron distribution in the presence of hydrogen, and also the ionicity of hydrogen in metals, but so far our study has been limited to pure FeTi. FeTi has the CsCl structure and thus Fe and Ti scatter with a phase difference of π into the 100-ref lections. Because Fe (Z = 26) is higher in the periodic system than Ti (Z = 22), an immediate “guess” would be that Fe has a larger scattering amplitude than Ti. However, relativistic Hartree-Fock calculations show that the opposite is the case for the 100-reflection. An explanation for this may be sought in the stronger localization of the d-electrons of the first row transition elements when moving to the right in the periodic table. The tabulated difference between fTi (100) and ffe (100) is small, however, and based on the values of the scattering amplitude for isolated atoms, the kinematical intensity of the 100-reflection is only 5.10-4 of the intensity of the 200-reflection.

Charge distribution on dust particles of space plasma

2003 ◽  
Vol 9 (4) ◽  
pp. 67-72 ◽  
Author(s):  
Yu.O. Klymenko ◽  
◽  
О.К. Cheremnykh ◽  
Keyword(s):  
Charge Distribution ◽  
Space Plasma ◽  
Dust Particles

Space Charge Distribution Measurement in FEP Film Irradiated by Proton

2020 ◽  
Vol 140 (10) ◽  
pp. 504-505
Author(s):  
Kaisei Enoki ◽  
Ushio Chiba ◽  
Hiroaki Miyake ◽  
Yasuhiro Tanaka
Keyword(s):  
Space Charge ◽  
Charge Distribution ◽  
Distribution Measurement ◽  
Space Charge Distribution

A New Computational Procedure to Predict Transient Hydroplaning Performance of a Tire

2001 ◽  
Vol 29 (1) ◽  
pp. 2-22 ◽  
Author(s):  
T. Okano ◽  
M. Koishi
Keyword(s):  
Complex Geometry ◽  
Fluid Flows ◽  
Computational Procedure ◽  
Vehicle Body ◽  
Fluid Viscosity ◽  
Safe Driving ◽  
Transient Phenomena ◽  
Vehicle Velocity ◽  
Fixed Reference ◽  
Volume Method

Abstract “Hydroplaning characteristics” is one of the key functions for safe driving on wet roads. Since hydroplaning depends on vehicle velocity as well as the tire construction and tread pattern, a predictive simulation tool, which reflects all these effects, is required for effective and precise tire development. A numerical analysis procedure predicting the onset of hydroplaning of a tire, including the effect of vehicle velocity, is proposed in this paper. A commercial explicit-type FEM (finite element method)/FVM (finite volume method) package is used to solve the coupled problems of tire deformation and flow of the surrounding fluid. Tire deformations and fluid flows are solved, using FEM and FVM, respectively. To simulate transient phenomena effectively, vehicle-body-fixed reference-frame is used in the analysis. The proposed analysis can accommodate 1) complex geometry of the tread pattern and 2) rotational effect of tires, which are both important functions of hydroplaning simulation, and also 3) velocity dependency. In the present study, water is assumed to be compressible and also a laminar flow, indeed the fluid viscosity, is not included. To verify the effectiveness of the method, predicted hydroplaning velocities for four different simplified tread patterns are compared with experimental results measured at the proving ground. It is concluded that the proposed numerical method is effective for hydroplaning simulation. Numerical examples are also presented in which the present simulation methods are applied to newly developed prototype tires.

NUMERICAL STUDY OF DETONATION PROPAGATION IN VISCOUS TURBULENT FLOW IN A DUCT

2020 ◽  
Author(s):  
V. A. SABELNIKOV ◽  
◽  
V. V. VLASENKO ◽  
S. BAKHNE ◽  
S. S. MOLEV ◽  
...  
Keyword(s):  
Complex Geometry ◽  
Numerical Study ◽  
Navier Stokes ◽  
Detonation Waves ◽  
Detonation Propagation ◽  
Eddy Simulation ◽  
Detonation Structure ◽  
Classical Studies ◽  
Large Eddy ◽  
Physical Effects

Gasdynamics of detonation waves was widely studied within last hundred years - analytically, experimentally, and numerically. The majority of classical studies of the XX century were concentrated on inviscid aspects of detonation structure and propagation. There was a widespread opinion that detonation is such a fast phenomenon that viscous e¨ects should have insigni¦cant in§uence on its propagation. When the era of calculations based on the Reynolds-averaged Navier- Stokes (RANS) and large eddy simulation approaches came into effect, researchers pounced on practical problems with complex geometry and with the interaction of many physical effects. There is only a limited number of works studying the in§uence of viscosity on detonation propagation in supersonic §ows in ducts (i. e., in the presence of boundary layers).

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