Running PHASTINPUT. Processing flow and transport data file. TITLE Central Oklahoma aquifer, demonstration of PHAST UNITS time years horizontal_grid meters vertical_grid meters head meters hydraulic_conductivity m/s specific_storage 1/m dispersivity m leaky_k m/sec leaky_thickness m flux m/day river_bed_thickness m river_bed_hydraulic_conductivity m/s well_diameter in well_flow_rate L/day GRID uniform x 0 90000 16 uniform y 0 48000 9 uniform z 0 400 5 print_orientation XY chemistry_dimensions XYZ FLOW_ONLY false STEADY_FLOW true head_tolerance 1e-3 flow_balance_tolerance 1e-3 FLUID_PROPERTIES compressibility 0.0 #1/Pa density 1000. #kg/m^3 viscosity 0.001 #Pa-s diffusivity 0.0 #m^2/s MEDIA zone 0. 0. 0. 90000. 48000. 400. porosity 0.22 long_dispersivity 4000. trans_dispersivity 50. kx 1.373e-5 ky 1.373e-5 kz 1.373e-7 storage 0 zone 48000. 0. 0. 90000. 48000. 100. active 0 RIVER 1 Canadian River default_width 200. default_depth 1. default_bed_thickness 1. default_bed_hydraulic_conductivity 1 default_solution 1 30000. 0 head 320. 90000. 0 head 275. RIVER 2 North Fork River default_width 200. default_depth 1. default_bed_thickness 1. default_bed_hydraulic_conductivity 1 default_solution 1 30000. 36000. head 335. 30000. 48000. head 320. 90000. 48000. head 245. RIVER 3 North Canadian River default_width 200. default_depth 1. default_bed_thickness 1. default_bed_hydraulic_conductivity 1 default_solution 1 60000. 30000. head 335. 90000. 20000. head 290. FLUX_BC zone 30000. 3000. 400. 90000. 45000. 400. flux -10e-5 associated_solution 1 SPECIFIED_VALUE_BC zone 30000. 14000 300. 32000. 20000. 400. head 348. associated_solution_composition 1 LEAKY_BC zone 0. 48000. 0. 29000. 48000. 400. hydraulic_conductivity 1.618e-5 thickness 30000. head 305.0 associated_solution 1 FREE_SURFACE_BC true WELL 1 Observation well 1 in arsenic zone 12000 36000 diameter 2 # inches pumping 1 # L/day elevation 90 110 # m HEAD_IC zone 0. 0. 0. 90000. 48000. 400. head 380. CHEMISTRY_IC zone 0. 0. 0. 90000. 48000. 400. solution 2 equilibrium_phases 2 exchange 2 surface 2 SOLUTION_METHOD direct_solver false tolerance 1e-10 space_differencing 0. time_differencing 1. TIME_CONTROL delta_time 2000 yr end_time 100000 yr PRINT_INITIAL velocities true xyz_head true xyz_ss_velocities true PRINT_FREQUENCY xyz_chemistry 50000 yr hdf_chemistry 2000 yr xyz_well 2000 yr save_final_heads true PRINT_LOCATIONS zone 0 0 0 90000 48000 0 print 0 END WARNING: Fluid compressibility has been set to zero for free surface calculation. WARNING: Aquifer compressibility has been set to zero for free surface calculation. PHASTINPUT done. Running PHAST. Running PHREEQC for initial conditions. Processing database file. SOLUTION_MASTER_SPECIES SOLUTION_SPECIES PHASES EXCHANGE_MASTER_SPECIES EXCHANGE_SPECIES SURFACE_MASTER_SPECIES SURFACE_SPECIES END Processing chemical data file. SURFACE_MASTER_SPECIES Surf SurfOH SURFACE_SPECIES SOLUTION_MASTER_SPECIES As H3AsO4 -1.0 74.9216 74.9216 SOLUTION_SPECIES SOLUTION 1 20 x precipitation END USE solution 1 EQUILIBRIUM_PHASES 1 Dolomite 0.0 2.7 Calcite 0.0 1.0 CO2(g) -1.5 100. SAVE solution 1 END SOLUTION 2 Brine END USE solution 2 EQUILIBRIUM_PHASES 2 Dolomite 0.0 2.7 Calcite 0.0 1.0 SAVE solution 2 END EXCHANGE 2 SURFACE 2 END SELECTED_OUTPUT USER_PUNCH END PHREEQC done. . Central Oklahoma aquifer, . demonstration of PHAST reading static data for flow and transport simulation WARNING: Multiple free surfaces in column of cells; Check initial condition on head field. A4 array dimension requirement (D4ZGCG iterative solver)......... NRAL . 0 elements Primary storage requirement (D4ZGCG iterative solver)............ NPRIST 6840 elements Overhead storage requirement (D4ZGCG iterative solver)........... NOHST . 34264 elements *** Calculation Information *** Direction index for d4 zig-zag renumbering ............ IDIR.. 1 Incomplete LU [f] or modified ILU [t] factorization ... MILU.. T Number of search directions before restart ............ NSDR.. 5 Tolerance on iterative solution ....................... EPSSLV 1.0E-10 Beginning flow calculation for steady-state i.c. Reading transient data for simulation: Set 1 WARNING: Automatic Time Step Control Parameters for Steady Flow Maximum pressure change allowed per time step.................... DPTAS 1.18E+06 (Pa ) Minimum time step required ...................................... DTIMMN 2.0 (yr ) Maximum time step allowed ....................................... DTIMMX 2.00E+06(yr ) Beginning steady state time step no. 1 Maximum change in potentiometric head .. -1.3312E+02 (m) at location ( 9.000E+04, 4.800E+04, 400. )(m) Fractional flow residual ............... -1.9439E+00 Beginning steady state time step no. 2 Maximum change in potentiometric head .. -2.3095E+01 (m) at location ( 9.000E+04, 4.800E+04, 200. )(m) Fractional flow residual ............... -1.9028E+00 Beginning steady state time step no. 3 Maximum change in potentiometric head .. -3.8663E+00 (m) at location ( 7.800E+04, 1.800E+04, 400. )(m) Fractional flow residual ............... -1.4759E+00 Beginning steady state time step no. 4 Maximum change in potentiometric head .. -6.3383E+00 (m) at location ( 7.800E+04, 1.800E+04, 400. )(m) Fractional flow residual ............... -1.0087E+00 Beginning steady state time step no. 5 Maximum change in potentiometric head .. -9.4795E+00 (m) at location ( 9.000E+04, 6.000E+03, 400. )(m) Fractional flow residual ............... -9.5331E-01 Beginning steady state time step no. 6 Maximum change in potentiometric head .. -1.3931E+01 (m) at location ( 9.000E+04, 6.000E+03, 400. )(m) Fractional flow residual ............... -8.6088E-01 Beginning steady state time step no. 7 Maximum change in potentiometric head .. -1.6528E+01 (m) at location ( 9.000E+04, 4.200E+04, 300. )(m) Fractional flow residual ............... -7.1811E-01 Beginning steady state time step no. 8 Maximum change in potentiometric head .. -1.7030E+01 (m) at location ( 9.000E+04, 3.600E+04, 300. )(m) Fractional flow residual ............... -5.2168E-01 Beginning steady state time step no. 9 Maximum change in potentiometric head .. -1.1431E+01 (m) at location ( 9.000E+04, 3.600E+04, 300. )(m) Fractional flow residual ............... -3.0728E-01 Beginning steady state time step no. 10 Maximum change in potentiometric head .. -1.1179E+01 (m) at location ( 0.000 , 6.000E+03, 400. )(m) Fractional flow residual ............... -1.4836E-01 Beginning steady state time step no. 11 Maximum change in potentiometric head .. -7.3995E+00 (m) at location ( 0.000 , 1.800E+04, 400. )(m) Fractional flow residual ............... -7.0581E-02 Beginning steady state time step no. 12 Maximum change in potentiometric head .. -5.4899E+00 (m) at location ( 0.000 , 0.000 , 300. )(m) Fractional flow residual ............... -2.5324E-02 Beginning steady state time step no. 13 Maximum change in potentiometric head .. -1.4528E+00 (m) at location ( 0.000 , 1.200E+04, 300. )(m) Fractional flow residual ............... -4.0607E-03 Beginning steady state time step no. 14 Maximum change in potentiometric head .. -1.3801E-01 (m) at location ( 0.000 , 1.800E+04, 300. )(m) Fractional flow residual ............... -5.7376E-04 Beginning steady state time step no. 15 Maximum change in potentiometric head .. -1.1866E-02 (m) at location ( 0.000 , 3.000E+04, 300. )(m) Fractional flow residual ............... -4.1143E-05 Beginning steady state time step no. 16 Maximum change in potentiometric head .. 9.0390E-04 (m) at location ( 2.400E+04, 1.200E+04, 300. )(m) Fractional flow residual ............... -5.3174E-06 Beginning steady state time step no. 17 Maximum change in potentiometric head .. 2.7542E-05 (m) at location ( 0.000 , 1.200E+04, 300. )(m) Fractional flow residual ............... -2.7135E-09 Beginning steady state time step no. 18 Current time step length ................................... 1.311E+05 (yr) No. of solver iterations, Relative residual: 3 3.4161738E-11 Maximum change in potentiometric head .. 1.3214E-06 (m) at location ( 4.800E+04, 1.800E+04, 400. )(m) Fractional flow residual ............... 2.8517E-09 Beginning steady state time step no. 19 Current time step length ................................... 2.621E+05 (yr) No. of solver iterations, Relative residual: 3 5.1382054E-11 Maximum change in potentiometric head .. -3.5555E-08 (m) at location ( 3.600E+04, 3.000E+04, 400. )(m) Fractional flow residual ............... 9.8500E-11 Done with steady-state flow. Equilibration of cells for initial conditions. Total cells: 657 Number of cells with same aqueous model: 529 Total iterations all cells: 0 Number of cells with zero iterations: 530 Maximum iterations for one cell: 0 Time at which next set of transient parameters will be read .......... TIMCHG 1.000E+05 (yr) Beginning transient simulation. Beginning time step no. 1 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 1 Time .................................................. 2.000E+03 (yr) Beginning time step no. 2 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 2 Time .................................................. 4.000E+03 (yr) Beginning time step no. 3 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 3 Time .................................................. 6.000E+03 (yr) Beginning time step no. 4 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 4 Time .................................................. 8.000E+03 (yr) Beginning time step no. 5 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 5 Time .................................................. 1.000E+04 (yr) Beginning time step no. 6 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 6 Time .................................................. 1.200E+04 (yr) Beginning time step no. 7 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 7 Time .................................................. 1.400E+04 (yr) Beginning time step no. 8 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 8 Time .................................................. 1.600E+04 (yr) Beginning time step no. 9 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 9 Time .................................................. 1.800E+04 (yr) Beginning time step no. 10 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 10 Time .................................................. 2.000E+04 (yr) Beginning time step no. 11 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 11 Time .................................................. 2.200E+04 (yr) Beginning time step no. 12 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 12 Time .................................................. 2.400E+04 (yr) Beginning time step no. 13 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 13 Time .................................................. 2.600E+04 (yr) Beginning time step no. 14 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 14 Time .................................................. 2.800E+04 (yr) Beginning time step no. 15 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 15 Time .................................................. 3.000E+04 (yr) Beginning time step no. 16 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 16 Time .................................................. 3.200E+04 (yr) Beginning time step no. 17 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 17 Time .................................................. 3.400E+04 (yr) Beginning time step no. 18 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 18 Time .................................................. 3.600E+04 (yr) Beginning time step no. 19 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 19 Time .................................................. 3.800E+04 (yr) Beginning time step no. 20 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 20 Time .................................................. 4.000E+04 (yr) Beginning time step no. 21 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 21 Time .................................................. 4.200E+04 (yr) Beginning time step no. 22 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 22 Time .................................................. 4.400E+04 (yr) Beginning time step no. 23 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 23 Time .................................................. 4.600E+04 (yr) Beginning time step no. 24 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 24 Time .................................................. 4.800E+04 (yr) Beginning time step no. 25 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 25 Time .................................................. 5.000E+04 (yr) Beginning time step no. 26 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 26 Time .................................................. 5.200E+04 (yr) Beginning time step no. 27 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 27 Time .................................................. 5.400E+04 (yr) Beginning time step no. 28 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 28 Time .................................................. 5.600E+04 (yr) Beginning time step no. 29 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 29 Time .................................................. 5.800E+04 (yr) Beginning time step no. 30 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 30 Time .................................................. 6.000E+04 (yr) Beginning time step no. 31 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 31 Time .................................................. 6.200E+04 (yr) Beginning time step no. 32 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 32 Time .................................................. 6.400E+04 (yr) Beginning time step no. 33 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 33 Time .................................................. 6.600E+04 (yr) Beginning time step no. 34 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 34 Time .................................................. 6.800E+04 (yr) Beginning time step no. 35 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 35 Time .................................................. 7.000E+04 (yr) Beginning time step no. 36 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 36 Time .................................................. 7.200E+04 (yr) Beginning time step no. 37 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 37 Time .................................................. 7.400E+04 (yr) Beginning time step no. 38 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 38 Time .................................................. 7.600E+04 (yr) Beginning time step no. 39 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 39 Time .................................................. 7.800E+04 (yr) Beginning time step no. 40 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 40 Time .................................................. 8.000E+04 (yr) Beginning time step no. 41 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 41 Time .................................................. 8.200E+04 (yr) Beginning time step no. 42 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 42 Time .................................................. 8.400E+04 (yr) Beginning time step no. 43 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 43 Time .................................................. 8.600E+04 (yr) Beginning time step no. 44 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 44 Time .................................................. 8.800E+04 (yr) Beginning time step no. 45 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 45 Time .................................................. 9.000E+04 (yr) Beginning time step no. 46 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 46 Time .................................................. 9.200E+04 (yr) Beginning time step no. 47 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 47 Time .................................................. 9.400E+04 (yr) Beginning time step no. 48 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 48 Time .................................................. 9.600E+04 (yr) Beginning time step no. 49 Beginning solute-transport calculation. H O As C Ca Cl Mg Na S Charge Beginning chemistry calculation. End of Time Step No. 49 Time .................................................. 9.800E+04 (yr) Beginning time step no. 50 Current time step length ................................... 2.000E+03 (yr) Beginning solute-transport calculation. H No. of solver iterations, Relative residual: 7 9.9006280E-11 O No. of solver iterations, Relative residual: 7 7.1245815E-11 As No. of solver iterations, Relative residual: 7 9.8553809E-11 C No. of solver iterations, Relative residual: 7 4.7869301E-11 Ca No. of solver iterations, Relative residual: 7 4.7338936E-11 Cl No. of solver iterations, Relative residual: 6 2.9764171E-11 Mg No. of solver iterations, Relative residual: 7 5.6332877E-11 Na No. of solver iterations, Relative residual: 7 1.8168590E-11 S No. of solver iterations, Relative residual: 6 3.2690907E-11 Charge No. of solver iterations, Relative residual: 7 1.8597661E-11 Beginning chemistry calculation. Total cells: 657 Number of cells with same aqueous model: 529 Total iterations all cells: 3040 Number of cells with zero iterations: 0 Maximum iterations for one cell: 15 End of Time Step No. 50 Time .................................................. 1.000E+05 (yr) Maximum change in potentiometric head -3.5555E-08 (m ) at location ( 3.600E+04, 3.000E+04, 400. )(m) Maximum change in H .................. -6.9092E-04 (mol/kgw) at location ( 4.200E+04, 2.400E+04, 0.000 )(m) Maximum change in O .................. -3.0076E-03 (mol/kgw) at location ( 6.000E+03, 4.800E+04, 100. )(m) Maximum change in As ................. -4.5911E-07 (mol/kgw) at location ( 2.400E+04, 4.200E+04, 0.000 )(m) Maximum change in C .................. -1.2292E-03 (mol/kgw) at location ( 6.000E+03, 4.800E+04, 0.000 )(m) Maximum change in Ca ................. -3.6729E-03 (mol/kgw) at location ( 0.000 , 6.000E+03, 300. )(m) Maximum change in Cl ................. -5.6199E-02 (mol/kgw) at location ( 6.000E+03, 6.000E+03, 0.000 )(m) Maximum change in Mg ................. -1.8152E-03 (mol/kgw) at location ( 0.000 , 1.200E+04, 300. )(m) Maximum change in Na ................. -4.5587E-02 (mol/kgw) at location ( 6.000E+03, 6.000E+03, 0.000 )(m) Maximum change in S .................. -3.7233E-05 (mol/kgw) at location ( 6.000E+03, 6.000E+03, 0.000 )(m) Maximum change in Charge ............. -1.9578E-03 (mol/kgw) at location ( 6.000E+03, 4.800E+04, 0.000 )(m) Done with transient simulation. ***** Simulation Completed ***** Last time value calculated ...................................... 1.0000E+05 (yr) Last time step index ............................................ 50