Model:PHREEQC

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PHREEQC


Metadata

Also known as
Model type Single
Model part of larger framework
Note on status model
Date note status model
Incorporated models or components:
Spatial dimensions 1D
Spatial extent Watershed-Scale
Model domain Hydrology, Terrestrial
One-line model description PHREEQC version 3 is a computer program written in the C and C++ programming languages that is designed to perform a wide variety of aqueous geochemical calculations
Extended model description PHREEQC implements several types of aqueous models: two ion-association aqueous models (the Lawrence Livermore National Laboratory model and WATEQ4F), a Pitzer specific-ion-interaction aqueous model, and the SIT (Specific ion Interaction Theory) aqueous model. Using any of these aqueous models, PHREEQC has capabilities for (1) speciation and saturation-index calculations; (2) batch-reaction and one-dimensional (1D) transport calculations with reversible and irreversible reactions, which include aqueous, mineral, gas, solid-solution, surface-complexation, and ion-exchange equilibria, and specified mole transfers of reactants, kinetically controlled reactions, mixing of solutions, and pressure and temperature changes; and (3) inverse modeling, which finds sets of mineral and gas mole transfers that account for differences in composition between waters within specified compositional uncertainty limits.
Keywords:

geochemical reaction model, inverse modeling, saturation indices, contaminant migration,

Name David Parkhurst
Type of contact Model developer
Institute / Organization USGS
Postal address 1 P.O. Box 25046, Mail Stop 418
Postal address 2
Town / City Denver
Postal code 80225
State Colorado
Country United States
Email address dlpark@usgs.gov
Phone
Fax


Supported platforms
Unix, Linux, Mac OS, Windows
Other platform
Programming language

C, C++

Other program language
Code optimized Single Processor
Multiple processors implemented
Nr of distributed processors
Nr of shared processors
Start year development 1980
Does model development still take place? Yes
If above answer is no, provide end year model development
Code development status
When did you indicate the 'code development status'?
Model availability As code
Source code availability
(Or provide future intension) 		Through web repository
Source web address http://wwwbrr.cr.usgs.gov/projects/GWC_coupled/phreeqc/
Source csdms web address
Program license type Other
Program license type other as defined in source code "NOTICE" file
Memory requirements --
Typical run time --


Describe input parameters All input for PHREEQC version 3 is defined in keyword data blocks, each of which may have a series of identifiers for specific types of data.; See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Input format ASCII
Other input format
Describe output parameters To many to list here, see Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Output format ASCII, Binary
Other output format
Pre-processing software needed? No
Describe pre-processing software
Post-processing software needed? No
Describe post-processing software
Visualization software needed? Yes
If above answer is yes
Other visualization software E.g. NetpathXL


Describe processes represented by the model See See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Describe key physical parameters and equations See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Describe length scale and resolution constraints See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Describe time scale and resolution constraints See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.
Describe any numerical limitations and issues See 'Description of Input and Examples for PHREEQC Version 3 - A computer program for speciation, batch-reaction, one-dimensional transport, and inverse geochemical calculations'.


Describe available calibration data sets
Upload calibration data sets if available:
Describe available test data sets
Upload test data sets if available:
Describe ideal data for testing


Do you have current or future plans for collaborating with other researchers?
Is there a manual available? Yes
Upload manual if available: Media:PHREEQC-tm6-A43.pdf
Model website if any http://wwwbrr.cr.usgs.gov/projects/GWC_coupled/phreeqc/
Model forum / discussion board http://www.phreeqcusers.org/
Comments


This part will be filled out by CSDMS staff

OpenMI compliant No but possible
BMI compliant No but possible
WMT component No but possible
PyMT component
Is this a data component
Can be coupled with:
Model info
Authors
David Parkhurst
Source code
Model citations
Nr. of publications: 314
Total citations: 9536
h-index: 43
m-quotient: 3.31
QR-code

Link to this page
Other models by author


Introduction

History

References



Nr. of publications: 314
Total citations: 9536
h-index: 43
m-quotient: 3.31


Publication(s)YearTypeCited
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PHREEQC
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PHREEQC
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[[| (View/edit entry)]]		PHREEQC
Model application Template:SEM 2297417278
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Model application Template:SEM 2257980161
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Model application Template:SEM 2194215436
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Model application Template:SEM 2619835499
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Model application Template:SEM 2615864248
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Model application Template:SEM 2621070286
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Model application Template:SEM 2772220772
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Model application Template:SEM 2560635459
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Model application Template:SEM 2512401337
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Model application Template:SEM 2541490911
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Model application Template:SEM 2744079634
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Model application Template:SEM 2746694385
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Model application Template:SEM 2777257532
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Model application Template:SEM 2741373038
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Model application Template:SEM 2575463360
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Model application Template:SEM 2768061401
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Model application Template:SEM 2573841069
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Model application Template:SEM 2573123520
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[[| (View/edit entry)]]		HYDRUS-1D
PHREEQC
Model application Template:SEM 2571650731
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Model application Template:SEM 2572799860
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Model application Template:SEM 2599520740
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Model application Template:SEM 2746883339
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Model application Template:SEM 2573204928
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Model application Template:SEM 2607346314
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Model application Template:SEM 2555525788
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Model application Template:SEM 2530622982
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Model application Template:SEM 2485564945
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Model application Template:SEM 2608985534
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Model application Template:SEM 2611090036
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Model application Template:SEM 2563613328
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Model application Template:SEM 2550216435
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Model application Template:SEM 2734945765
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Model application Template:SEM 2749807022
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Model overview 0
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. . , , .
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Model application Template:SEM 2763216630
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Model application Template:SEM 2774030162
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Model application Template:SEM 2572620603
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Model application Template:SEM 2748308344
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Model application Template:SEM 2548891540
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Model application Template:SEM 2762765095
Error: Table AuthorsMan not found.
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Model application Template:SEM 2787713105
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Model application Template:SEM 2735763957
Error: Table AuthorsMan not found.
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Model application Template:SEM 2409584111
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Model application Template:SEM 2587920524
Error: Table AuthorsMan not found.
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Model application Template:SEM 2607274641
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Model application Template:SEM 2754089820
Error: Table AuthorsMan not found.
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Model application Template:SEM 2469081826
Error: Table AuthorsMan not found.
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Model application Template:SEM 2754249588
Error: Table AuthorsMan not found.
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Model application Template:SEM 2569413806
Error: Table AuthorsMan not found.
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Model application Template:SEM 2795232804
Error: Table AuthorsMan not found.
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Model application Template:SEM 2890026870
Error: Table AuthorsMan not found.
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Model application Template:SEM 2886609620
Error: Table AuthorsMan not found.
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Model application Template:SEM 2884982751
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Model application Template:SEM 2896113441
Error: Table AuthorsMan not found.
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Model application Template:SEM 2888898537
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Model application Template:SEM 2797705168
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Model application Template:SEM 2883007245
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Model application Template:SEM 2887054737
Error: Table AuthorsMan not found.
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Model application Template:SEM 2790546760
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Model application Template:SEM 2899292299
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Model application Template:SEM 2804176249
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Model application Template:SEM 2897751449
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Model application Template:SEM 2896135575
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Model application Template:SEM 2799491480
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Model application Template:SEM 2896381119
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Model application Template:SEM 2895782042
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Model application Template:SEM 2897793357
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Model application Template:SEM 2884693477
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SWAT
Model application Template:SEM 2907902446
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Model application Template:SEM 2792533813
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Model application Template:SEM 2767476344
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Model application Template:SEM 3012318517
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Model application Template:SEM 2883604703
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Model application Template:SEM 2785077668
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Model application Template:SEM 2793584141
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Model application Template:SEM 2783369630
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Model application Template:SEM 2790415728
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Model application Template:SEM 2800979359
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Model application Template:SEM 2771351232
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Model application Template:SEM 2770383986
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Model application Template:SEM 2903073896
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Model application Template:SEM 2884385940
Error: Table AuthorsMan not found.
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Model application Template:SEM 2884736430
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Model application Template:SEM 2799848229
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Model application Template:SEM 2794377002
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Model application Template:SEM 2810792186
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Model application Template:SEM 2761389355
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Model application Template:SEM 2758638425
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Model application Template:SEM 2883117678
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Model application Template:SEM 2793797328
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Model application Template:SEM 2799526559
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. . , , .
[[| (View/edit entry)]]		CaveCalc
PHREEQC
Model application Template:SEM 2883039937
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Model application Template:SEM 2888595711
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Model application Template:SEM 2808974491
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Model application Template:SEM 2763261657
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Model application Template:SEM 2776227047
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Model application Template:SEM 2792450670
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Model application Template:SEM 2913107236
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Model application Template:SEM 2612542944
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Model application Template:SEM 2810469840
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Model application Template:SEM 2888741410
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Model application Template:SEM 2971068773
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Model application Template:SEM 2909991025
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Model application Template:SEM 2996606266
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Model application Template:SEM 2924173569
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Model application Template:SEM 2987057703
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Model application Template:SEM 2970253467
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Model application Template:SEM 2954408695
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Model application Template:SEM 2968988152
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Model application Template:SEM 2997849278
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Model application Template:SEM 2918033737
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Model application Template:SEM 2922490126
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Model application Template:SEM 2946405463
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Model application Template:SEM 2921862537
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Model application Template:SEM 2991455080
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Model application Template:SEM 2888280753
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Model application Template:SEM 2948133244
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Model application Template:SEM 2982554450
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Model application Template:SEM 2989521186
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Model application Template:SEM 2922719228
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Model application Template:SEM 2971680427
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Model application Template:SEM 2980916919
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Model application Template:SEM 2985931139
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Model application Template:SEM 2993736178
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Model application Template:SEM 2982625755
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Model application Template:SEM 2923697431
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Model application Template:SEM 2979862414
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Model application Template:SEM 2909170306
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Model application Template:SEM 2921760190
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Model application Template:SEM 2610165012
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Model application Template:SEM 2949577972
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Model application Template:SEM 2958136832
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[[| (View/edit entry)]]		PEST
PHREEQC
Model application Template:SEM 2938750738
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Model application Template:SEM 2941429107
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Model application Template:SEM 2946052230
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Model application Template:SEM 2919855608
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Model application Template:SEM 2954627845
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Model application Template:SEM 2944267044
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Model application Template:SEM 2937670570
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Model application Template:SEM 2911021485
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Model application Template:SEM 2798112820
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Model application Template:SEM 2975260617
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Model application Template:SEM 2992275368
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Model application Template:SEM 2910355806
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Model application Template:SEM 2887197273
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Model application Template:SEM 2744290336
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Model application Template:SEM 2912006524
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Model application Template:SEM 2910318840
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Model application Template:SEM 2948549293
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Model application Template:SEM 2912882278
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Model application Template:SEM 2996847227
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Model application Template:SEM 2948067437
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Model application Template:SEM 2951106369
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Model application Template:SEM 2912085716
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Model application Template:SEM 2921220697
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Model application Template:SEM 2965687021
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Model application Template:SEM 2994644829
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Model application Template:SEM 2883784487
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Model application Template:SEM 2970488829
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Model application Template:SEM 2971898380
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Model application Template:SEM 2945949879

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