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Parallel CFD Simulation
   “Fast Reactor Assembly”


Kurt D. Hamman

Multi-Physics Methods Group
Nuclear Science & Energy


July 21, 2008
Presentation Overview
• Project Objectives
   – Problem Size
• M&S Process
   – “Pre-processing”
   – “Solver Settings”
   – “Post-processing”
• Validation Process
• HPC “Lesson’s Learned”
• Conclusions
Project Objectives
• Primary
  – Develop a CFD Modeling Process using Commercial
    Software for “large” problems
     ( CAD → Meshing → Simulation → Visualization )
• Secondary
  – Evaluate Commercial Software
     • CAD and CFD
  – Evaluate HPC and Network Infrastructure
     • Problem Size (“production-type” simulations)
Project Objectives – “Problem Size”
  65 – 85 million elements
                                Meshing ~ 1 to 2 days
 1 million ≈ 1 GB memory
    File Size → ~ 25 GB             HPC (Meshing)
                             Aurora (SGI Altix – 4700)
                             • Shared Memory - 256 GB
                             • 96 - 1.5 GHz Itanium 2 Processors
                             • SUSE Linux Enterprise Server 10
                             • 5.72 TB Disk Capacity



                              Simulation ~ 2 to 10 days
                                         HPC (Simulation)
                             • Icestorm (Altix ICE 8200)
                             • Distributed Memory(16 GB/Node)
                             • 256 Nodes/8 PPN
                             • 2.66 GHz clock speed
                             • Linux OS
Modeling Process
                               19-Pin Fast Reactor Assembly
                Geometry
                     &
                                                                                               Results
              “Surface Mesh”                             Mesh
                                   Meshing                      Solver                             +
CAD                                    (HPC)                     (HPC)                        Validation




                                                                                                        19 Pin Fuel Assembly

                                                                                       0.18                                                 0.03500


                                                                                       0.16
                                                                                                                                            0.03000

                                                                                       0.14

                                                                                                                                            0.02500
                                                                                       0.12


                                                                                                                                            0.02000
                                                                                       0.10




                                                                          ( kpa/cm )
                                                                                                                                                               Empirical




                                                                                                                                                      ( cm )
                                                                                                                                                               Numerical
                                                                                                                                                               Pin Gap
                                                                                       0.08
                                                                                                                                            0.01500


                                                                                       0.06
                                                                                                                                            0.01000

                                                                                       0.04

                                                                                                                                  Pin Gap   0.00500
                                                                                       0.02


                                                                                       0.00                                                 0.00000
                                                                                               C(1)       C(2)                 C(3)
                                                                                                         Model




                                                                                                      Validation


                                                                Results
                                  Polyhedral Mesh
                               (65.5 million elements)
Solid Model
“Preprocessing” – CAD Modeling
•     Geometry “similar” to Advanced Burner Test Reactor (ABTR)




                                                                                                                                                         19 Pin Assembly


                                                                                                                      Overlap
                                                                                                                      (0.0065 cm)




    Todreas, N.E. & Kazimi, M.S., Nuclear Systems II
    Elements of Thermal Hydraulic Design, Taylor and Francis, 2001.

                                                           Ds (3)                                                                Dft            Dl
                Model           Pins           D                          P/D            P            ΔP            Δg                                     Length         T (2)             F (2)
                ABTR            217          0.800         0.103         1.130         0.904         0.001         0.033        13.598          -           260          0.0797             0.174
                 M(1)            19          0.800         0.103         1.169         0.936         0.039         0.032        4.299         2.482         20.0         0.2001             0.675
                 M(2)            19          0.800         0.103         1.149         0.919         0.023         0.016        4.210         2.431         20.0         0.1113             0.708
                 M(3)            19          0.800         0.103         1.135         0.908         0.012         0.005        4.148         2.395         20.0         0.0498             0.799
                 M(4)            19          0.800         0.103         1.127         0.902         0.005         0.005        4.126         2.382         20.3         0.0273             0.634
             Notes:
             1. All dimensions in centimeters.
             2. Assembly geometry based on Todreas and Kazimi, where quot;Tquot; represents the flat-to-flat tolerance and quot;Fquot; represents the fraction of assembly tolerance distributed within the rods.
“Preprocessing” – Mesh
                         Boundary Layer
                          (Prism Cells)




                          Interior Volume
                         (Polyhedral Cells)
Modeling Process “Solver”
 •   3 Dimensional
 •   “Steady-State”
 •   Sodium Properties (700 K)
 •   Constant Density
 •   Segregated Solver
 •   Second Order (convective)
 •   Turbulent Flow
 •   Turbulence Models: k-ε k-ω
 •   Boundary Conditions
     –   Inlet velocity 2 m/s
     –   Outlet pressure 0 psi
     –   Walls “no slip”
     –   Heat Flux ~ 1MW/m2
Modeling Process “Post-processing”
Modeling Process “Post-processing”
Modeling Process “Post-processing”
Validation Process
          Examine Iterative Convergence

               ● 3 to 4 orders of magnitude
          Examine Conservation

               ● conservation of mass/energy
X         Examine Spatial (Grid) Convergence
                ● ordered discretization error
X         Examine Temporal Convergence
                ● N/A → Steady State Simulation
          Compare CFD Results to Data

                ● “Average” Pressure Drop
                ● “Average” Mass Flowrate
          Examine Model Uncertainties

                ● Turbulence Models/Solvers

       Performed
X       Not Performed

    Reference: NPARC Alliance CFD Verification and Validation Web Site
               (www.grc.nasa.gov/WWW/wind/valid/validation.html)
Validation – Iterative Convergence
                                     Energy Equation Residual Response
                            1. Activating heat transfer (q” ~ 1 MW/m2 )
                            2. Sdr and Tke “noise




          85 Million Element Model (3.02.003)
Validation – Examine Consistency
                                      Polyhedral Mesh
                                                  Numerical
            Interior Pin   Wall-Pin         Inlet           Outlet     Delta      Difference
             Clearance      Gap        mass flowrate mass flowrate      Δm        (wrt inlet)
    Model       (cm)        (cm)           (kg/s)           (kg/s)     (kg/s)
     C(1)      0.039        0.032          1.083            1.083    6.000E-06      0.00%
     C(2)      0.023        0.016          0.971            0.971    1.500E-06      0.00%
     C(3)      0.012        0.005          0.896            0.896    6.900E-06      0.00%

                                                 Numerical
            Interior Pin   Wall-Pin    Heat Transfer Heat Transfer      Delta     Difference
             Clearance      Gap             quot;inquot;           quot;outquot;         ΔQ       (wrt inlet)
    Model       (cm)        (cm)            (W)             (W)          (W)
     C(1)      0.039        0.032       1.621E+06       1.620E+06    -1.636E+03    -0.10%
     C(2)      0.023        0.016       1.453E+06       1.451E+06    -1.534E+03    -0.11%
     C(3)      0.012        0.005       1.340E+06       1.338E+06    -1.666E+03    -0.12%
Validation-Spatial Grid Convergence
             65 – 85 million elements
             1 million ≈ 1 Gb memory
               File Size → ~ 25 GB
             (HPC Lessons Learned)
Validation-Temporal Convergence
• Steady-State Simulation
   – Not performed
• General Comments
   – File size ~27.5 GB
   – 1000 second transient
   – 27.5 TB storage
• Suggests a Need
   – Parallel I/O            Reference 5: “Advanced Burner Test Reactor Pre-Conceptual Design Report”


   – File Storage
Sensitivity Analyses Overview

•   Analysis #1
     – Assembly Geometry Changes
     – Several Turbulence Models
     – Empirical Correlations
•   Analysis #2
     – Wirewrap Geometry Changes
     – One Turbulence Model
     – Empirical Correlations
•   Analysis #3
     – Mesh element types
       (polyhedral, trimmer)
HPC “Lessons Learned”
• Understand Capabilities
   – Network
   – HPC Machines
   – Software
   – Productivity
      • Optimization
   – Memory Access
      • Mesh Refinement
      • Post processing
      • Unknowns
   – File Size
Understand Capabilities – “Network”
                                         PRIMARY FIRE WALL




                          Subnet #1        Subnet #2         Subnet #3




                                             e

               Business
               Enclave                            HPC                    Research
                                                 Enclave                 Enclave




 Note: For illustration purposes only.
Understand Capabilities – “Network”
Understand Capabilities – “Machines”
 65 – 85 million elements
                               Meshing ~ 1 to 2 days
 1 million ≈ 1 Gb memory
   File Size → ~ 25 Gb             HPC (Meshing)
                            Aurora (SGI Altix – 4700)
                            • Shared Memory - 256 GB
                            • 96 - 1.5 GHz Itanium 2 Processors
                            • SUSE Linux Enterprise Server 10
                            • 5.72 TB Disk Capacity



                             Simulation ~ 2 to 10 days
                                        HPC (Simulation)
                            • Icestorm (Altix ICE 8200)
                            • Distributed Memory(16 GB/Node)
                            • 256 Nodes/8 PPN
                            • 2.66 GHz clock speed
                            • Linux OS
Understand Capabilities - “Software”

 • SolidWorks
   – Compatibility with CFD Software
   – Functionality
      • Design Changes
      • Equations
 • CD-adapco STAR-CCM+
   – Physics
   – Compatibility
      • CAD Software
      • HPC Hardware
      • 3rd Party Post-Processors
Understand Capabilities – “Productivity”
                  Optimization
           (i.e. Visualization & Speedup)
Understand Capabilities – “Productivity”

                         “GREY SCREEN”




 Causes                            Results
 Dedicated Master Node → I/O       Loss of Data
 Problems Size                     Problem Restart
 Network/Software Limitations      Visualization/Analysis Limitations
Understand Capabilities - Productivity
                                                        Icestorm/Altix ICE 8200 - Speedup
                                                   (19-Pin 65 Million Elements, CCM+ 3.02.003)



               18.0


               16.0


               14.0


               12.0
    Speed-up




               10.0
                                                                                                                                Star-CCM+
                                                                                                                                Linear
                8.0


                6.0


                4.0


                2.0


                0.0
                      0   64   128   192   256   320   384   448    512    576    640   704      768   832   896   960   1024

                                                               Processes
Understand Capabilities - Architecture




                                 e

      Business
                          Icestorm (Altix ICE 8200)
      Enclave                           HPC
                                       Enclave
                 • Distributed Memory(16 GB/Node)
                 • 256 Nodes/8 PPN
                 • 2.66 GHz clock speed
                 • Linux OS
Understand Capabilities - Architecture


 • Productivity  ~30%

    – core count ↔
    – double nodes

                         e
 • Operate Machine
   50% Business
       Rated Capacity
       Enclave                HPC

                     
    – Productivity           Enclave
Understand Capabilities – “File Size”

 27 GB File Size
 • Storage
    – Parallel I/O
    – Optimal Topology
    – Save Times
 • Collaboration
    – File transfer
    – File sharing
Conclusions
•   M&S “Large Problems” is Challenging
     – CAD/Meshing
         • parallel mesher needed
     – Simulation/Visualization
•   Validation is Challenging
     – experimental data availability
•   Understand Capabilities and Limitations
     – software
     – HPC machines
     – network infrastructure
     – human infrastructure
•   Key Success Factor → “SYNERGY”
References
1.   K.D. Hamman and R.A. Berry, “A CFD M&S Process for Fast Reactor Fuel
     Assemblies,” Experiments and CFD Code Applications to Nuclear Reactor
     Safety (XCFD4NRS 2008), Grenoble, France, accepted, 2008.
2.   CD-adapco, “Star-CCM+ (2.08.004) User Guide”, 2007.
3.   N. E. Todreas and M. S. Kazimi, “Nuclear Systems I, Thermal Hydraulic
     Fundamentals,” Hemisphere Publishing Corporation, 1990.
4.   N. E. Todreas and M. S. Kazimi, “Nuclear Systems II, Elements of Thermal
     Hydraulic Design,” Taylor and Francis, 2001.
5.   Y. I. Chang, P. J. Finck, and C. Grandy, “Advanced Burner Test Reactor
     Preconceptual Design Report,” ANL-ABR-1, September 2006.
6.   E. H. Novendstern, Turbulent Flow Pressure Drop Model for Fuel Rod
     Assemblies Utilizing a Helical Wire-Wrap Spacer System, Nuclear
     Engineering Design, Vol. 22, pp. 19-27, 1972.
7.   K. Rehme, Pressure Drop Correlations for Fuel Element Spacers, Nuclear
     Technology, Vol. 17, pp. 15-23, 1972.
8.   R. Gajapathy, et al., CFD investigation of helical wire-wrapped 7-pin fuel
     bundle and the challenges in modeling full scale 217 pin bundle, Nuclear
     Engineering and Design (2007), doi:10.1016/j.nucengdes.2007.05.003.
9.   NPARC Alliance CFD Verification and Validation Web Site
     (www.grc.nasa.gov/WWW/wind/valid/validation.html), accessed 11/1/07.

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Modeling & Simulation

  • 1. Parallel CFD Simulation “Fast Reactor Assembly” Kurt D. Hamman Multi-Physics Methods Group Nuclear Science & Energy July 21, 2008
  • 2. Presentation Overview • Project Objectives – Problem Size • M&S Process – “Pre-processing” – “Solver Settings” – “Post-processing” • Validation Process • HPC “Lesson’s Learned” • Conclusions
  • 3. Project Objectives • Primary – Develop a CFD Modeling Process using Commercial Software for “large” problems ( CAD → Meshing → Simulation → Visualization ) • Secondary – Evaluate Commercial Software • CAD and CFD – Evaluate HPC and Network Infrastructure • Problem Size (“production-type” simulations)
  • 4. Project Objectives – “Problem Size” 65 – 85 million elements Meshing ~ 1 to 2 days 1 million ≈ 1 GB memory File Size → ~ 25 GB HPC (Meshing) Aurora (SGI Altix – 4700) • Shared Memory - 256 GB • 96 - 1.5 GHz Itanium 2 Processors • SUSE Linux Enterprise Server 10 • 5.72 TB Disk Capacity Simulation ~ 2 to 10 days HPC (Simulation) • Icestorm (Altix ICE 8200) • Distributed Memory(16 GB/Node) • 256 Nodes/8 PPN • 2.66 GHz clock speed • Linux OS
  • 5. Modeling Process 19-Pin Fast Reactor Assembly Geometry & Results “Surface Mesh” Mesh Meshing Solver + CAD (HPC) (HPC) Validation 19 Pin Fuel Assembly 0.18 0.03500 0.16 0.03000 0.14 0.02500 0.12 0.02000 0.10 ( kpa/cm ) Empirical ( cm ) Numerical Pin Gap 0.08 0.01500 0.06 0.01000 0.04 Pin Gap 0.00500 0.02 0.00 0.00000 C(1) C(2) C(3) Model Validation Results Polyhedral Mesh (65.5 million elements) Solid Model
  • 6. “Preprocessing” – CAD Modeling • Geometry “similar” to Advanced Burner Test Reactor (ABTR) 19 Pin Assembly Overlap (0.0065 cm) Todreas, N.E. & Kazimi, M.S., Nuclear Systems II Elements of Thermal Hydraulic Design, Taylor and Francis, 2001. Ds (3) Dft Dl Model Pins D P/D P ΔP Δg Length T (2) F (2) ABTR 217 0.800 0.103 1.130 0.904 0.001 0.033 13.598 - 260 0.0797 0.174 M(1) 19 0.800 0.103 1.169 0.936 0.039 0.032 4.299 2.482 20.0 0.2001 0.675 M(2) 19 0.800 0.103 1.149 0.919 0.023 0.016 4.210 2.431 20.0 0.1113 0.708 M(3) 19 0.800 0.103 1.135 0.908 0.012 0.005 4.148 2.395 20.0 0.0498 0.799 M(4) 19 0.800 0.103 1.127 0.902 0.005 0.005 4.126 2.382 20.3 0.0273 0.634 Notes: 1. All dimensions in centimeters. 2. Assembly geometry based on Todreas and Kazimi, where quot;Tquot; represents the flat-to-flat tolerance and quot;Fquot; represents the fraction of assembly tolerance distributed within the rods.
  • 7. “Preprocessing” – Mesh Boundary Layer (Prism Cells) Interior Volume (Polyhedral Cells)
  • 8. Modeling Process “Solver” • 3 Dimensional • “Steady-State” • Sodium Properties (700 K) • Constant Density • Segregated Solver • Second Order (convective) • Turbulent Flow • Turbulence Models: k-ε k-ω • Boundary Conditions – Inlet velocity 2 m/s – Outlet pressure 0 psi – Walls “no slip” – Heat Flux ~ 1MW/m2
  • 12. Validation Process Examine Iterative Convergence  ● 3 to 4 orders of magnitude Examine Conservation  ● conservation of mass/energy X Examine Spatial (Grid) Convergence ● ordered discretization error X Examine Temporal Convergence ● N/A → Steady State Simulation Compare CFD Results to Data  ● “Average” Pressure Drop ● “Average” Mass Flowrate Examine Model Uncertainties  ● Turbulence Models/Solvers  Performed X Not Performed Reference: NPARC Alliance CFD Verification and Validation Web Site (www.grc.nasa.gov/WWW/wind/valid/validation.html)
  • 13. Validation – Iterative Convergence Energy Equation Residual Response 1. Activating heat transfer (q” ~ 1 MW/m2 ) 2. Sdr and Tke “noise 85 Million Element Model (3.02.003)
  • 14. Validation – Examine Consistency Polyhedral Mesh Numerical Interior Pin Wall-Pin Inlet Outlet Delta Difference Clearance Gap mass flowrate mass flowrate Δm (wrt inlet) Model (cm) (cm) (kg/s) (kg/s) (kg/s) C(1) 0.039 0.032 1.083 1.083 6.000E-06 0.00% C(2) 0.023 0.016 0.971 0.971 1.500E-06 0.00% C(3) 0.012 0.005 0.896 0.896 6.900E-06 0.00% Numerical Interior Pin Wall-Pin Heat Transfer Heat Transfer Delta Difference Clearance Gap quot;inquot; quot;outquot; ΔQ (wrt inlet) Model (cm) (cm) (W) (W) (W) C(1) 0.039 0.032 1.621E+06 1.620E+06 -1.636E+03 -0.10% C(2) 0.023 0.016 1.453E+06 1.451E+06 -1.534E+03 -0.11% C(3) 0.012 0.005 1.340E+06 1.338E+06 -1.666E+03 -0.12%
  • 15. Validation-Spatial Grid Convergence 65 – 85 million elements 1 million ≈ 1 Gb memory File Size → ~ 25 GB (HPC Lessons Learned)
  • 16. Validation-Temporal Convergence • Steady-State Simulation – Not performed • General Comments – File size ~27.5 GB – 1000 second transient – 27.5 TB storage • Suggests a Need – Parallel I/O Reference 5: “Advanced Burner Test Reactor Pre-Conceptual Design Report” – File Storage
  • 17. Sensitivity Analyses Overview • Analysis #1 – Assembly Geometry Changes – Several Turbulence Models – Empirical Correlations • Analysis #2 – Wirewrap Geometry Changes – One Turbulence Model – Empirical Correlations • Analysis #3 – Mesh element types (polyhedral, trimmer)
  • 18. HPC “Lessons Learned” • Understand Capabilities – Network – HPC Machines – Software – Productivity • Optimization – Memory Access • Mesh Refinement • Post processing • Unknowns – File Size
  • 19. Understand Capabilities – “Network” PRIMARY FIRE WALL Subnet #1 Subnet #2 Subnet #3 e Business Enclave HPC Research Enclave Enclave Note: For illustration purposes only.
  • 21. Understand Capabilities – “Machines” 65 – 85 million elements Meshing ~ 1 to 2 days 1 million ≈ 1 Gb memory File Size → ~ 25 Gb HPC (Meshing) Aurora (SGI Altix – 4700) • Shared Memory - 256 GB • 96 - 1.5 GHz Itanium 2 Processors • SUSE Linux Enterprise Server 10 • 5.72 TB Disk Capacity Simulation ~ 2 to 10 days HPC (Simulation) • Icestorm (Altix ICE 8200) • Distributed Memory(16 GB/Node) • 256 Nodes/8 PPN • 2.66 GHz clock speed • Linux OS
  • 22. Understand Capabilities - “Software” • SolidWorks – Compatibility with CFD Software – Functionality • Design Changes • Equations • CD-adapco STAR-CCM+ – Physics – Compatibility • CAD Software • HPC Hardware • 3rd Party Post-Processors
  • 23. Understand Capabilities – “Productivity” Optimization (i.e. Visualization & Speedup)
  • 24. Understand Capabilities – “Productivity” “GREY SCREEN” Causes Results Dedicated Master Node → I/O Loss of Data Problems Size Problem Restart Network/Software Limitations Visualization/Analysis Limitations
  • 25. Understand Capabilities - Productivity Icestorm/Altix ICE 8200 - Speedup (19-Pin 65 Million Elements, CCM+ 3.02.003) 18.0 16.0 14.0 12.0 Speed-up 10.0 Star-CCM+ Linear 8.0 6.0 4.0 2.0 0.0 0 64 128 192 256 320 384 448 512 576 640 704 768 832 896 960 1024 Processes
  • 26. Understand Capabilities - Architecture e Business Icestorm (Altix ICE 8200) Enclave HPC Enclave • Distributed Memory(16 GB/Node) • 256 Nodes/8 PPN • 2.66 GHz clock speed • Linux OS
  • 27. Understand Capabilities - Architecture • Productivity  ~30% – core count ↔ – double nodes e • Operate Machine 50% Business Rated Capacity Enclave HPC  – Productivity Enclave
  • 28. Understand Capabilities – “File Size” 27 GB File Size • Storage – Parallel I/O – Optimal Topology – Save Times • Collaboration – File transfer – File sharing
  • 29. Conclusions • M&S “Large Problems” is Challenging – CAD/Meshing • parallel mesher needed – Simulation/Visualization • Validation is Challenging – experimental data availability • Understand Capabilities and Limitations – software – HPC machines – network infrastructure – human infrastructure • Key Success Factor → “SYNERGY”
  • 30. References 1. K.D. Hamman and R.A. Berry, “A CFD M&S Process for Fast Reactor Fuel Assemblies,” Experiments and CFD Code Applications to Nuclear Reactor Safety (XCFD4NRS 2008), Grenoble, France, accepted, 2008. 2. CD-adapco, “Star-CCM+ (2.08.004) User Guide”, 2007. 3. N. E. Todreas and M. S. Kazimi, “Nuclear Systems I, Thermal Hydraulic Fundamentals,” Hemisphere Publishing Corporation, 1990. 4. N. E. Todreas and M. S. Kazimi, “Nuclear Systems II, Elements of Thermal Hydraulic Design,” Taylor and Francis, 2001. 5. Y. I. Chang, P. J. Finck, and C. Grandy, “Advanced Burner Test Reactor Preconceptual Design Report,” ANL-ABR-1, September 2006. 6. E. H. Novendstern, Turbulent Flow Pressure Drop Model for Fuel Rod Assemblies Utilizing a Helical Wire-Wrap Spacer System, Nuclear Engineering Design, Vol. 22, pp. 19-27, 1972. 7. K. Rehme, Pressure Drop Correlations for Fuel Element Spacers, Nuclear Technology, Vol. 17, pp. 15-23, 1972. 8. R. Gajapathy, et al., CFD investigation of helical wire-wrapped 7-pin fuel bundle and the challenges in modeling full scale 217 pin bundle, Nuclear Engineering and Design (2007), doi:10.1016/j.nucengdes.2007.05.003. 9. NPARC Alliance CFD Verification and Validation Web Site (www.grc.nasa.gov/WWW/wind/valid/validation.html), accessed 11/1/07.