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8th US/German Workshop on Salt Repository
Research, Design, and Operation
PFLOTRAN-RepoTREND code intercomparison
Dirk-A. Becker
GRS
Middelburg, The Netherlands
September 5-7, 2017
The RepoTREND Code Package
 RepoTREND is a new final repository simulator, developed by GRS since 2007
 Provides functionalities for simulating
 the release of contaminants,
 their transport through the near-field and far-field to the biosphere,
 the estimation of the radiological consequences for man and environment.
 Applicable for different repository concepts in different host formations
2
Near Field Modules
 Radionuclide mobilisation and
one-phase transport in a
repository in salt rock
 Corrosion of waste canisters
 Radionuclide mobilisation
 Advection, dispersion, diffusion
 Radioactive decay
 Salt creep (rock convergence)
 Compaction of crushed salt
 Gas generation
 Sorption
 Precipitation / dissolution
LOPOS
 One-phase diffusive transport
through a fully saturated porous
medium
 Radial or planar geometry
 Radionuclide mobilisation
 Diffusion
 Radioactive decay
 Sorption
 Precipitation / dissolution
 Dilution in near-surface aquifer
CLAYPOS
Biosphere
Bentonite
Container
ClayFormation1
ClayFormation2
Matrix
Precipitate
Container
water
Geotechnical
Barrier
Geological
Barrier
Thoughts about the Test System
(biased by RepoTREND ...)
 Observation point A (overburden)
 Radionuclides reach the aquifer
before and are carried away
 No pathway to point A
 No radionuclides reach point A!
 Observation point B (rock salt)
 1000 m (!) away from the source
 No pathway to point B
 Very low diffusion through undisturbed rock salt
 No radionuclides ever reach point B!
 Shaft
 Crosses the aquifer 100 m above the drift
 Radionuclides assumed to enter the aquifer at that point
 Only the lower 100 m of the shaft are relevant! 4
RepoTREND Models
 CLAYPOS model
 No shaft
 Diffusion through
Drift – DRZ – Salt
 LOPOS model 1
 No shaft
 Drift directly connected to aquifer
 Convergence-driven advective flow
 LOPOS model 2
 Like LOPOS model 1 but with shaft
 Shaft connected to the aquifer
 LOPOS model 3
 Like LOPOS model 2 but with discretization of drift
5
CLAYPOS Model (Diffusion)
6
Container
Drift
DRZ
Salt Rock
 Cylindrical geometry
 Cross-sections calculated
from agreed test case data
 Radial 1D-Diffusion
 Salt rock limited
to 10 m
 Salt rock fully
surrounded by
aquifer
 Calculation of
diffusive flows
Time [yrs]
Outflow[mol/yr]
100
101
102
103
104
105
106
107
108
10-21
10-19
10-17
10-15
10-13
10-11
10-9
10-7
10-5
10-3
I 129
Am 241
Np 237
U 233
Th 229
W:bexbenchmarkFiguresoutflow.layP:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow-cmp.lay
Time [yrs]
Outflow[mol/yr]
100
101
102
103
104
105
106
107
108
10-21
10-19
10-17
10-15
10-13
10-11
10-9
10-7
10-5
10-3
I 129
Am 241
Np 237
U 233
Th 229
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow-cmp.lay
CLAYPOS Model:
Outflow from Waste Form
7
 Close agreement
with SNL results
 Except Am-241
CLAYPOS Model:
Total Radionuclide Content
 öoipurt
8
Time [yrs]
Inventory[mol]
10
0
10
1
10
2
10
3
10
4
10
5
10
6
10
7
10
8
10
-5
10
-3
10
-1
10
1
10
3
10
5
I 129
Am 241
Np 237
U 233
Th 229
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-total.lay
CLAYPOS Model:
Outflow to the Aquifer (10 m)
Time [yrs]
Outflow[mol/yr]
100
101
102
103
104
105
106
107
108
10-25
10-20
10-15
10
-10
10
-5
I 129
Am 241
Np 237
U 233
Th 229
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow_10m.lay
9
 Relevant outflow
only for non-
sorbing I-129
 Note: Dilution in
the aquifer not
taken into
account!
LOPOS Model 1
 One rectangular drift
 Porous backfill (crushed salt)
 One long waste container
 Drift center directly
connected to the aquifer
(via interface segment)
 Instantaneously filled with
saturated NaCl solution
 Instantaneous mixing in
horizontal direction
 Convergence by salt creep
 reference convergence rate:
1∙10-3 /a
 Calculation of radionuclide
flow (advective, diffusive) to
the aquifer
10
Drift
Salt Rock
5 m
5m
2.78m²
Aquifer
LOPOS Model 1:
Total Radionuclide Content
Time [yrs]
Mobileinventory[mol]
10
0
10
1
10
2
10
3
10
4
10
5
10
6
10
7
10
8
10
-5
10
-3
10
-1
10
1
10
3
10
5
I 129
AM 241
NP 237
U 233
TH 229
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS1-total.lay
Dashed: CLAYPOS results
11
 Relevant
difference to
CLAYPOS only for
non-sorbing I-129
 I-129 leaves the
near field by
advection
LOPOS Model 2
 Same drift as in LOPOS model 1
 Shaft with non-compressible
backfill
 permeability 10-18 m²
 Height of shaft: 100 m
 Shaft discretized in 5 sections
 Calculation of radionuclide flow
(advective, diffusive) to the
aquifer
12
Drift
Salt Rock
5 m
5m
2.78m²
Aquifer
100m
LOPOS Models 1 and 2:
Outflow from Near Field
Time [yrs]
Outflow[mol/yr]
10
0
10
1
10
2
10
3
10
4
10
5
10
6
10
7
10
8
10
-13
10
-11
10
-9
10
-7
10
-5
10
-3
10
-1
Volume Flow
I 129
AM 241
NP 237
U 233
TH 229
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS2-1-flow.lay
Dashed: without shaft
Solid: with shaft
13
End porosity reached:
Convergence stops
Further transport only
by diffusion
LOPOS Model 2:
Drift Resistance and Porosity
Time [yrs]
FlowResistance
Porosity
100
101
102
103
104
105
106
107
108
10-3
10
-1
10
1
10
3
105
107
10
9
10
11
1013
0
0.05
0.1
0.15
0.2
Drift resistance
Shaft resistance
Drift porosity (mean)
P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS2-res-por.lay
14
LOPOS Model 3 (to be done)
 Drift separated in 5 parts
 Identical waste containers in
each part
 Shaft connected to the
middle one
 Calculation of horizontal flow
and radionuclide transport
 Yet no results
Drift
Salt Rock
5 m
5m
2.78m²
100m
Aquifer
Discussion of Results
 Time-development of radionuclide inventory in good
agreement with PFLOTRAN results (exception: Am-241)
 Diffusive flow through rock salt is very low
 Relevant transport to the aquifer only for non-sorbing I-129
 Shaft does not reduce the volume flow but acts as a sorbing
buffer
 Shaft even leads to increase of maximum outflow (Np-237)
 Drift reaches end porosity of 10-5 after some 800000 years
16
Change the test case?
Higher model output might be better for comparison
 Observation points closer to the waste
 Lower sorption, at least in the shaft
 Increase reference convergence rate (0.01/yr ?)
 Introduce additional brine reservoir (chamber)
 Reduce model time
Thank you for your attention!
17

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06a PFLOTRAN-RepoTREND code intercomparison

  • 1. 8th US/German Workshop on Salt Repository Research, Design, and Operation PFLOTRAN-RepoTREND code intercomparison Dirk-A. Becker GRS Middelburg, The Netherlands September 5-7, 2017
  • 2. The RepoTREND Code Package  RepoTREND is a new final repository simulator, developed by GRS since 2007  Provides functionalities for simulating  the release of contaminants,  their transport through the near-field and far-field to the biosphere,  the estimation of the radiological consequences for man and environment.  Applicable for different repository concepts in different host formations 2
  • 3. Near Field Modules  Radionuclide mobilisation and one-phase transport in a repository in salt rock  Corrosion of waste canisters  Radionuclide mobilisation  Advection, dispersion, diffusion  Radioactive decay  Salt creep (rock convergence)  Compaction of crushed salt  Gas generation  Sorption  Precipitation / dissolution LOPOS  One-phase diffusive transport through a fully saturated porous medium  Radial or planar geometry  Radionuclide mobilisation  Diffusion  Radioactive decay  Sorption  Precipitation / dissolution  Dilution in near-surface aquifer CLAYPOS Biosphere Bentonite Container ClayFormation1 ClayFormation2 Matrix Precipitate Container water Geotechnical Barrier Geological Barrier
  • 4. Thoughts about the Test System (biased by RepoTREND ...)  Observation point A (overburden)  Radionuclides reach the aquifer before and are carried away  No pathway to point A  No radionuclides reach point A!  Observation point B (rock salt)  1000 m (!) away from the source  No pathway to point B  Very low diffusion through undisturbed rock salt  No radionuclides ever reach point B!  Shaft  Crosses the aquifer 100 m above the drift  Radionuclides assumed to enter the aquifer at that point  Only the lower 100 m of the shaft are relevant! 4
  • 5. RepoTREND Models  CLAYPOS model  No shaft  Diffusion through Drift – DRZ – Salt  LOPOS model 1  No shaft  Drift directly connected to aquifer  Convergence-driven advective flow  LOPOS model 2  Like LOPOS model 1 but with shaft  Shaft connected to the aquifer  LOPOS model 3  Like LOPOS model 2 but with discretization of drift 5
  • 6. CLAYPOS Model (Diffusion) 6 Container Drift DRZ Salt Rock  Cylindrical geometry  Cross-sections calculated from agreed test case data  Radial 1D-Diffusion  Salt rock limited to 10 m  Salt rock fully surrounded by aquifer  Calculation of diffusive flows
  • 7. Time [yrs] Outflow[mol/yr] 100 101 102 103 104 105 106 107 108 10-21 10-19 10-17 10-15 10-13 10-11 10-9 10-7 10-5 10-3 I 129 Am 241 Np 237 U 233 Th 229 W:bexbenchmarkFiguresoutflow.layP:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow-cmp.lay Time [yrs] Outflow[mol/yr] 100 101 102 103 104 105 106 107 108 10-21 10-19 10-17 10-15 10-13 10-11 10-9 10-7 10-5 10-3 I 129 Am 241 Np 237 U 233 Th 229 P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow-cmp.lay CLAYPOS Model: Outflow from Waste Form 7  Close agreement with SNL results  Except Am-241
  • 8. CLAYPOS Model: Total Radionuclide Content  öoipurt 8 Time [yrs] Inventory[mol] 10 0 10 1 10 2 10 3 10 4 10 5 10 6 10 7 10 8 10 -5 10 -3 10 -1 10 1 10 3 10 5 I 129 Am 241 Np 237 U 233 Th 229 P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-total.lay
  • 9. CLAYPOS Model: Outflow to the Aquifer (10 m) Time [yrs] Outflow[mol/yr] 100 101 102 103 104 105 106 107 108 10-25 10-20 10-15 10 -10 10 -5 I 129 Am 241 Np 237 U 233 Th 229 P:a401projekteRepoTREND+praesentationenUSGER-2017figuresCLAYPOS-outflow_10m.lay 9  Relevant outflow only for non- sorbing I-129  Note: Dilution in the aquifer not taken into account!
  • 10. LOPOS Model 1  One rectangular drift  Porous backfill (crushed salt)  One long waste container  Drift center directly connected to the aquifer (via interface segment)  Instantaneously filled with saturated NaCl solution  Instantaneous mixing in horizontal direction  Convergence by salt creep  reference convergence rate: 1∙10-3 /a  Calculation of radionuclide flow (advective, diffusive) to the aquifer 10 Drift Salt Rock 5 m 5m 2.78m² Aquifer
  • 11. LOPOS Model 1: Total Radionuclide Content Time [yrs] Mobileinventory[mol] 10 0 10 1 10 2 10 3 10 4 10 5 10 6 10 7 10 8 10 -5 10 -3 10 -1 10 1 10 3 10 5 I 129 AM 241 NP 237 U 233 TH 229 P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS1-total.lay Dashed: CLAYPOS results 11  Relevant difference to CLAYPOS only for non-sorbing I-129  I-129 leaves the near field by advection
  • 12. LOPOS Model 2  Same drift as in LOPOS model 1  Shaft with non-compressible backfill  permeability 10-18 m²  Height of shaft: 100 m  Shaft discretized in 5 sections  Calculation of radionuclide flow (advective, diffusive) to the aquifer 12 Drift Salt Rock 5 m 5m 2.78m² Aquifer 100m
  • 13. LOPOS Models 1 and 2: Outflow from Near Field Time [yrs] Outflow[mol/yr] 10 0 10 1 10 2 10 3 10 4 10 5 10 6 10 7 10 8 10 -13 10 -11 10 -9 10 -7 10 -5 10 -3 10 -1 Volume Flow I 129 AM 241 NP 237 U 233 TH 229 P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS2-1-flow.lay Dashed: without shaft Solid: with shaft 13 End porosity reached: Convergence stops Further transport only by diffusion
  • 14. LOPOS Model 2: Drift Resistance and Porosity Time [yrs] FlowResistance Porosity 100 101 102 103 104 105 106 107 108 10-3 10 -1 10 1 10 3 105 107 10 9 10 11 1013 0 0.05 0.1 0.15 0.2 Drift resistance Shaft resistance Drift porosity (mean) P:a401projekteRepoTREND+praesentationenUSGER-2017figuresLOPOS2-res-por.lay 14
  • 15. LOPOS Model 3 (to be done)  Drift separated in 5 parts  Identical waste containers in each part  Shaft connected to the middle one  Calculation of horizontal flow and radionuclide transport  Yet no results Drift Salt Rock 5 m 5m 2.78m² 100m Aquifer
  • 16. Discussion of Results  Time-development of radionuclide inventory in good agreement with PFLOTRAN results (exception: Am-241)  Diffusive flow through rock salt is very low  Relevant transport to the aquifer only for non-sorbing I-129  Shaft does not reduce the volume flow but acts as a sorbing buffer  Shaft even leads to increase of maximum outflow (Np-237)  Drift reaches end porosity of 10-5 after some 800000 years 16
  • 17. Change the test case? Higher model output might be better for comparison  Observation points closer to the waste  Lower sorption, at least in the shaft  Increase reference convergence rate (0.01/yr ?)  Introduce additional brine reservoir (chamber)  Reduce model time Thank you for your attention! 17