Development of atomic mobility with quantified uncertainties directly from concentration profiles: a demo in fcc Cu–Ni–Sn system

2022 ◽  
Author(s):  
Ying Tang ◽  
Biao Zhang ◽  
Jing Zhong ◽  
Chengyi Xiong ◽  
Jinkui Cai ◽  
...  
Keyword(s):  
Concentration Profiles ◽  
Atomic Mobility

scholarly journals Experimental investigation and computer simulation of diffusion in Pt-coated bulk Ni

2010 ◽  
Vol 46 (2) ◽  
pp. 153-160 ◽  
Author(s):  
W. Gong ◽  
L. Zhang ◽  
M. Ode ◽  
H. Murakami ◽  
C. Zhou
Keyword(s):  
Thin Film ◽  
Experimental Investigation ◽  
Electron Probe ◽  
Bulk Diffusion ◽  
Concentration Profiles ◽  
Atomic Mobility ◽  
Measured Concentration ◽  
Calculated Concentration ◽  
Higher Temperature ◽  
Interdiffusion Coefficients

The concentration profiles of thin-film Pt/bulk Ni coatings annealed at 1150, 1250 and 1300?C for different time were measured by means of electron probe microanalysis. The corresponding interdiffusion coefficients were then determined using the thin-film solution. The calculated concentration profiles based on the presently obtained interdiffusion coefficients agree well with the experimental ones, but better at a higher temperature or a longer time. The comparison between the presently measured concentration profiles and the DICTRA simulated ones indicates that it is promising to apply the well-established atomic mobility databases due to bulk diffusion information in coating systems with some simple modifications for diffusivities.

Measured and Modelled Chlorinated Contaminant Distributions in the St. Clair River Water

1986 ◽  
Vol 21 (3) ◽  
pp. 332-343 ◽  
Author(s):  
C.H. Chan ◽  
Y.L. Lau ◽  
B.G. Oliver
Keyword(s):  
River Water ◽  
Suspended Sediment ◽  
Water Samples ◽  
Concentration Distribution ◽  
Suspended Solids ◽  
Industrial Area ◽  
Concentration Profiles ◽  
Detroit River ◽  
Chemical Partitioning ◽  
Transverse Mixing

Abstract The concentration distribution of hexachlorobutadiene (HCBD), pentachloro-benzene (QCB), hexachlorobenzene (HCB) and octachlorostyrene (OCS) in water samples from transects across the upper and lower St. Clair River and the upper Detroit River were determined on four occasions in 1985. The data show a plume of these contaminants from the Sarnia industrial area. The fluxes and concentration profiles of the contaminants at Port Lambton have been modelled success fully using a simple transverse mixing model. A study on the chemical partitioning between the “dissolved” and “suspended sediment” phases shows that an important contaminant fraction is carried in the river by the suspended solids, particularly for lipophilie compounds such as HCB and OCS,

A Stationary Packer System for Layerwise Groundwater Sampling in Monitoring Wells – Technique and Results

1991 ◽  
Vol 23 (1-3) ◽  
pp. 545-553
Author(s):  
M. Rödelsperger ◽  
U. Rohmann ◽  
F. Frimmel
Keyword(s):  
Groundwater Discharge ◽  
Groundwater Table ◽  
Experimental Results ◽  
Concentration Profiles ◽  
Sampling Device ◽  
Local Conditions ◽  
Monitoring Wells ◽  
Deep Aquifers ◽  
Groundwater Sampling ◽  
Groundwater Samples

A sampling device was designed as a stationary equipment for deep monitoring wells in order to obtain representative groundwater samples from different layers of the aquifer. The device consists of several packer units which can be combined at variable distances, allowing adaption to the local conditions of the aquifer and of the well. The pumps are situated below the groundwater table. Each of the drawing tubes ends between two packers at the concerning depth. Experimental results demonstrate the importance of the application of a stationary packer system instead of a mobile doublepacker in deep aquifers of inhomogeneous structure. Examples of concentration profiles obtained from layerwise groundwater sampling are given and a technique for selective groundwater discharge is described.

Selection of one-dimensional sedimentation: models for on-line use

1995 ◽  
Vol 31 (2) ◽  
pp. 193-204 ◽  
Author(s):  
Koen Grijspeerdt ◽  
Peter Vanrolleghem ◽  
Willy Verstraete
Keyword(s):  
Steady State ◽  
Selection Criteria ◽  
Data Sets ◽  
Concentration Profiles ◽  
A Posteriori ◽  
One Dimensional ◽  
On Line ◽  
Dynamic Concentration ◽  
Selection Of ◽  
Modelling Task

A comparative study of several recently proposed one-dimensional sedimentation models has been made. This has been achieved by fitting these models to steady-state and dynamic concentration profiles obtained in a down-scaled secondary decanter. The models were evaluated with several a posteriori model selection criteria. Since the purpose of the modelling task is to do on-line simulations, the calculation time was used as one of the selection criteria. Finally, the practical identifiability of the models for the available data sets was also investigated. It could be concluded that the model of Takács et al. (1991) gave the most reliable results.

Modeling mass transfer and substrate utilization in the boundary layer of biofilm systems

1998 ◽  
Vol 37 (4-5) ◽  
pp. 139-147 ◽  
Author(s):  
Harald Horn ◽  
Dietmar C. Hempel
Keyword(s):  
Boundary Layer ◽  
Mass Transfer ◽  
Reynolds Number ◽  
Film Theory ◽  
Substrate Utilization ◽  
The Other ◽  
Concentration Profiles ◽  
Hydrodynamic Conditions ◽  
Time Axis ◽  
Transfer Coefficients

The use of microelectrodes in biofilm research allows a better understanding of intrinsic biofilm processes. Little is known about mass transfer and substrate utilization in the boundary layer of biofilm systems. One possible description of mass transfer can be obtained by mass transfer coefficients, both on the basis of the stagnant film theory or with the Sherwood number. This approach is rather formal and not quite correct when the heterogeneity of the biofilm surface structure is taken into account. It could be shown that substrate loading is a major factor in the description of the development of the density. On the other hand, the time axis is an important factor which has to be considered when concentration profiles in biofilm systems are discussed. Finally, hydrodynamic conditions become important for the development of the biofilm surface when the Reynolds number increases above the range of 3000-4000.

An experimental study of gas phase back mixing under the counter-current gas-liquid flow on a vertical expanded metal sheet packing by static tracer technique

1980 ◽  
Vol 45 (1) ◽  
pp. 214-221
Author(s):  
Jan Červenka ◽  
Mirko Endršt ◽  
Václav Kolář
Keyword(s):  
Gas Phase ◽  
Flow Model ◽  
Plug Flow ◽  
Packed Bed ◽  
Metal Sheet ◽  
Concentration Profiles ◽  
Expanded Metal ◽  
Gas Liquid Flow ◽  
Counter Current ◽  
Back Mixing

Gas phase back mixing has been measured in a column packed with vertical expanded metal sheet under the counter-current flow of gas and liquid by the static method using a tracer. The observed experimental concentration profiles has not confirmed our earlier proposed model of back mixing, based on the concentration profiles in absorption runs. These profiles do not even conform with the axially dispersed plug flow model currently used to describe axial mixing in packed bed columns. The concentration profiles may be described by a combination of the axially dispersed plug flow model with back flow.

scholarly journals Migration of mineral oil in elastomers

2021 ◽  
Author(s):  
Tobias Förster ◽  
Artur Blivernitz
Keyword(s):  
Diffusion Coefficients ◽  
Mineral Oil ◽  
Activation Energies ◽  
Concentration Profiles ◽  
Small Reservoir ◽  
Experimental Procedure ◽  
Mineral Oils ◽  
The Absolute ◽  
Suitable Measure

AbstractThis work describes a newly introduced experimental procedure to quantify the diffusion progress of mineral oils locally resolved in NBR. Diffusion of reference oils IRM 901, IRM 902 and IRM 903 in NBR with various acrylonitrile contents was investigated. Classical sorption experiments were performed as a basic characterization and compared to the newly introduced method. Here, elastomer specimens are only being dipped with the bottom in a relatively small reservoir of mineral oil. This provides a determination of locally resolved concentration profiles of mineral oils, and the calculation of diffusion coefficients. These diffusion coefficients follow the same trends like those determined via sorption experiments. Despite differences in the absolute numbers, activation energies of diffusion can be applied as a suitable measure for the compatibility of elastomers and fluids.

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