REACTION RATES MEASUREMENT ACROSS THE PRESSURE VESSEL OF CHOOZ-A PWR BY SELF-DOSIMETRY TECHNIQUE

2003 ◽  
Author(s):  
D. Beretz ◽  
C. Destouches ◽  
A. Bache
Keyword(s):  
Pressure Vessel ◽  
Reaction Rates

3D Calculations of PWR Vessels Neutron Fluence With EFLUVE 3D Code

2013 ◽  
Author(s):  
Cécile-Aline Gosmain ◽  
Sylvain Rollet ◽  
Damien Schmitt
Keyword(s):  
Monte Carlo ◽  
Fast Neutron ◽  
Pressure Vessel ◽  
Reaction Rate ◽  
Neutron Fluence ◽  
Neutron Transport ◽  
Reaction Rates ◽  
Surveillance Program ◽  
Monte Carlo Code ◽  
Neutron Sources

In the framework of surveillance program dosimetry, the main parameter in the determination of the fracture toughness and the integrity of the reactor pressure vessel (RPV) is the fast neutron fluence on pressure vessel. Its calculated value is extrapolated using neutron transport codes from measured reaction rate value on dosimeters located on the core barrel. EDF R&D has developed a new 3D tool called EFLUVE3D based on the adjoint flux theory. This tool is able to reproduce on a given configuration the neutron flux, fast neutron fluence and reaction rate or dpa results of an exact Monte Carlo calculation with nearly the same accuracy. These EFLUVE3D calculations does the Source*Importance product which allows the calculation of the flux, the neutronic fluence (flux over 1MeV integrated on time) received at any point of the interface between the skin and the pressure vessel but also at the capsules of the pressurized water reactor vessels surveillance program and the dpa and reaction rates at different axial positions and different azimuthal positions of the vessel as well as at the surveillance capsules. Moreover, these calculations can be carried out monthly for each of the 58 reactors of the French current fleet in challenging time (less than 10mn for the total fluence and reaction rates calculations considering 14 different neutron sources of a classical power plant unit compared to more than 2 days for a classic Monte Carlo flux calculation at a given neutron source). The code needs as input: - for each reaction rate, the geometric importance matrix produced for a 3D pin by pin mesh on the basis of Green’s functions calculated by the Monte Carlo code TRIPOLI; - the neutron sources calculated on assemblies data (enrichment, position, fission fraction as a function of evolution), pin by pin power and irradiation. These last terms are based on local in-core activities measurements extrapolated to the whole core by use of the EDF core calculation scheme and a pin by pin power reconstruction methodology. This paper presents the fundamental principles of the code and its validation comparing its results to the direct Monte Carlo TRIPOLI results. Theses comparisons show a discrepancy of less than 0,5% between the two codes equivalent to the order of magnitude of the stochastic convergence of Monte Carlo results.

SEM analysis of the change in the reaction rates with deposit structures in the copper-iron cementation system

1978 ◽  
Vol 36 (1) ◽  
pp. 456-457
Author(s):  
V. Annamalai ◽  
L.E. Murr
Keyword(s):  
Structural Characteristics ◽  
Secondary Electron Emission ◽  
Copper Deposit ◽  
Reaction Rates ◽  
Sem Analysis ◽  
Experimental Conditions ◽  
Major Drawback ◽  
Emission Mode ◽  
Scrap Iron ◽  
Image Position

Economical recovery of copper metal from leach liquors has been carried out by the simple process of cementing copper onto a suitable substrate metal, such as scrap-iron, since the 16th century. The process has, however, a major drawback of consuming more iron than stoichiometrically needed by the reaction.Therefore, many research groups started looking into the process more closely. Though it is accepted that the structural characteristics of the resultant copper deposit cause changes in reaction rates for various experimental conditions, not many systems have been systematically investigated. This paper examines the deposit structures and the kinetic data, and explains the correlations between them.A simple cementation cell along with rotating discs of pure iron (99.9%) were employed in this study to obtain the kinetic results The resultant copper deposits were studied in a Hitachi Perkin-Elmer HHS-2R scanning electron microscope operated at 25kV in the secondary electron emission mode.

The Effects of Nitrogen on Electrical and Structural Properties in TaSixNy/SiO2/p-Si MOS Capacitors

2002 ◽  
Vol 716 ◽  
Author(s):  
You-Seok Suh ◽  
Greg Heuss ◽  
Jae-Hoon Lee ◽  
Veena Misra
Keyword(s):  
Structural Properties ◽  
Electron Spectroscopy ◽  
Oxygen Diffusion ◽  
Gate Dielectric ◽  
Barrier Properties ◽  
Reaction Rates ◽  
Cross Sectional ◽  
Mos Capacitors ◽  
Transmission Electron ◽  
Thermal Stability Of

AbstractIn this work, we report the effects of nitrogen on electrical and structural properties in TaSixNy /SiO2/p-Si MOS capacitors. TaSixNy films with various compositions were deposited by reactive sputtering of TaSi2 or by co-sputtering of Ta and Si targets in argon and nitrogen ambient. TaSixNy films were characterized by Rutherford backscattering spectroscopy and Auger electron spectroscopy. It was found that the workfunction of TaSixNy (Si>Ta) with varying N contents ranges from 4.2 to 4.3 eV. Cross-sectional transmission electron microscopy shows no indication of interfacial reaction or crystallization in TaSixNy on SiO2, resulting in no significant increase of leakage current in the capacitor during annealing. It is believed that nitrogen retards reaction rates and improves the chemical-thermal stability of the gate-dielectric interface and oxygen diffusion barrier properties.

Mcc Corrosion Tests at Reference Testing Conditions for A27 Cast steel in Hanford Ground Water

1986 ◽  
Vol 84 ◽  
Author(s):  
M.D. Merz ◽  
F. Gerber ◽  
R. Wang
Keyword(s):  
Pacific Northwest ◽  
Pressure Vessel ◽  
Static Pressure ◽  
Cast Steel ◽  
Statistical Treatment ◽  
Testing Conditions ◽  
Corrosion Tests ◽  
Corrosion Rates ◽  
High Level Nuclear Waste ◽  
High Level

AbstractThe Materials Characterization Center (MCC) at Pacific Northwest Lab- oratory is performing three kinds of corrosion tests for the Basalt Waste Isolation Project (BWIP) to establish the interlaboratory reproducibility and uncertainty of corrosion rates of container materials for high-level nuclear waste. The three types of corrosion tests were selected to address two distinct conditions that are expected in a repository constructed in basalt. An air/steam test is designed to address corrosion during the operational period and static pressure vessel and flowby tests are designed to address corrosion under conditions that bound the condi ring the post-closure period of the repository.The results of tests at reference testing conditions, which were defined to facilitate interlaboratory comparison of data, are presented. Data are reported for the BWIP/MCC-105.5 Air/Steam Test, BWIP/MCC-105.1 Static Pressure Vessel, and BWIP/MC-105.4 Flowby Test. In those cases where data are available from a second laboratory, a statistical analysis of interlaboratory results is reported and expected confidence intervals for mean corrosion rates are given. Other statistical treatment of data include analyses of the effects of vessel-to-vessel variations, test capsule variations for the flowby test, and oven-to-oven variations for air/steam tests.

Hydrostibination of Alkynes: A Radical Mechanism

2020 ◽  
Author(s):  
Josh MacMillan ◽  
Katherine Marczenko ◽  
Erin Johnson ◽  
Saurabh Chitnis
Keyword(s):  
Density Functional ◽  
Activation Barrier ◽  
Closed Shell ◽  
Reaction Rates ◽  
Radical Mechanism ◽  
Neutral Radical ◽  
Kinetic Isotope ◽  
Rate Limiting Step ◽  
Ionic Mechanisms ◽  
Terminal Acetylenes

The addition of Sb-H bonds to alkynes was reported recently as a new hydroelementation reaction that exclusively yields anti-Markovnikov <i>Z</i>-olefins from terminal acetylenes. We examine four possible mechanisms that are consistent with the observed stereochemical and regiochemical outcomes. A comprehensive analysis of solvent, substituent, isotope, additive, and temperature effects on hydrostibination reaction rates definitively refutes three ionic mechanisms involving closed-shell charged intermediates. Instead the data support a fourth pathway featuring neutral radical Sb<sup>II</sup> and Sb<sup>III</sup> intermediates. Density Functional Theory (DFT) calculations are consistent this model, predicting an activation barrier that is within 1 kcal mol<sup>-1</sup> of the experimental value (Eyring analysis) and a rate limiting step that is congruent with experimental kinetic isotope effect. We therefore conclude that hydrostibination of arylacetylenes is initiated by the generation of stibinyl radicals, which then participate in a cycle featuring Sb<sup>II</sup> and Sb<sup>III</sup> intermediates to yield the observed <i>Z</i>-olefins as products. This mechanistic understanding will enable rational evolution of hydrostibination as a methodology for accessing challenging products such as <i>E</i>-olefins.

A Conserved Asparagine in a Ubiquitin Conjugating Enzyme Positions the Substrate for Nucleophilic Attack

2018 ◽  
Author(s):  
Walker M. Jones ◽  
Aaron G. Davis ◽  
R. Hunter Wilson ◽  
Katherine L. Elliott ◽  
Isaiah Sumner
Keyword(s):  
Molecular Dynamics ◽  
Quantum Mechanics ◽  
Molecular Mechanics ◽  
Reaction Rates ◽  
Nucleophilic Attack ◽  
Classical Molecular Dynamics ◽  
Ubiquitin Conjugating Enzyme ◽  
Conjugating Enzyme

We present classical molecular dynamics (MD), Born-Oppenheimer molecular dynamics (BOMD), and hybrid quantum mechanics/molecular mechanics (QM/MM) data. MD was performed using the GPU accelerated pmemd module of the AMBER14MD package. BOMD was performed using CP2K version 2.6. The reaction rates in BOMD were accelerated using the Metadynamics method. QM/MM was performed using ONIOM in the Gaussian09 suite of programs. Relevant input files for BOMD and QM/MM are available.

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