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git-subtree-dir: phreeqc3-examples git-subtree-mainline: 8de0e98ed90bb2b639659c820168ab18c1062992 git-subtree-split: e977363da4c1ae1708ebddca38d5312b6813a337
248 lines
7.2 KiB
Plaintext
248 lines
7.2 KiB
Plaintext
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PRINT ; -reset false; -echo_input true; -user_print true
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# filter cells at tracer-in side...
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SOLUTION 4; -water 1.3963e-03
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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# cells in Opalinus Clay...
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SOLUTION 5; -water 7.7322e-05
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 5; -equil 5;
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Su_ 3.8224e-04 5.2840e+05 6.6087e-04
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Su_ii 7.4371e-06
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Su_fes 6.9841e-07
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-Donnan 1.6711e-09
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EXCHANGE 5; -equil 5;
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X 4.6718e-04
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SOLUTION 6; -water 9.5113e-05
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 6; -equil 6;
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Su_ 4.7019e-04 5.2840e+05 8.1293e-04
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Su_ii 9.1484e-06
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Su_fes 8.5911e-07
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-Donnan 1.6711e-09
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EXCHANGE 6; -equil 6;
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X 5.7468e-04
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SOLUTION 7; -water 1.1291e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 7; -equil 7;
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Su_ 5.5814e-04 5.2840e+05 9.6500e-04
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Su_ii 1.0860e-05
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Su_fes 1.0198e-06
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-Donnan 1.6711e-09
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EXCHANGE 7; -equil 7;
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X 6.8218e-04
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SOLUTION 8; -water 1.3070e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 8; -equil 8;
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Su_ 6.4610e-04 5.2840e+05 1.1171e-03
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Su_ii 1.2571e-05
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Su_fes 1.1805e-06
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-Donnan 1.6711e-09
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EXCHANGE 8; -equil 8;
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X 7.8967e-04
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SOLUTION 9; -water 1.4849e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 9; -equil 9;
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Su_ 7.3405e-04 5.2840e+05 1.2691e-03
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Su_ii 1.4282e-05
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Su_fes 1.3412e-06
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-Donnan 1.6711e-09
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EXCHANGE 9; -equil 9;
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X 8.9717e-04
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SOLUTION 10; -water 1.6628e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 10; -equil 10;
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Su_ 8.2200e-04 5.2840e+05 1.4212e-03
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Su_ii 1.5994e-05
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Su_fes 1.5019e-06
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-Donnan 1.6711e-09
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EXCHANGE 10; -equil 10;
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X 1.0047e-03
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SOLUTION 11; -water 1.8407e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 11; -equil 11;
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Su_ 9.0996e-04 5.2840e+05 1.5733e-03
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Su_ii 1.7705e-05
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Su_fes 1.6626e-06
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-Donnan 1.6711e-09
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EXCHANGE 11; -equil 11;
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X 1.1122e-03
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SOLUTION 12; -water 2.0186e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 12; -equil 12;
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Su_ 9.9791e-04 5.2840e+05 1.7253e-03
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Su_ii 1.9416e-05
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Su_fes 1.8233e-06
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-Donnan 1.6711e-09
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EXCHANGE 12; -equil 12;
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X 1.2197e-03
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SOLUTION 13; -water 2.1966e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 13; -equil 13;
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Su_ 1.0859e-03 5.2840e+05 1.8774e-03
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Su_ii 2.1127e-05
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Su_fes 1.9840e-06
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-Donnan 1.6711e-09
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EXCHANGE 13; -equil 13;
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X 1.3272e-03
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SOLUTION 14; -water 2.3745e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 14; -equil 14;
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Su_ 1.1738e-03 5.2840e+05 2.0295e-03
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Su_ii 2.2839e-05
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Su_fes 2.1448e-06
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-Donnan 1.6711e-09
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EXCHANGE 14; -equil 14;
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X 1.4347e-03
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SOLUTION 15; -water 2.5524e-04
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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SURFACE 15; -equil 15;
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Su_ 1.2618e-03 5.2840e+05 2.1815e-03
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Su_ii 2.4550e-05
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Su_fes 2.3055e-06
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-Donnan 1.6711e-09
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EXCHANGE 15; -equil 15;
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X 1.5422e-03
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# tracer-out filter cells...
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SOLUTION 16; -water 5.0266e-03
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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# outside solution...
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SOLUTION 17; -water 2.0000e-01
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pH 7.6; pe 14 O2(g) -1.0; temp 23
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Na 240; K 1.61; Mg 16.9; Ca 25.8; Sr 0.505
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Cl 300; S(6) 14.1; Fe(2) 0.0; Alkalinity 0.476
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END
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PHASES
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A_Hto
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Hto = Hto; log_k -15
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A_Na_tr
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Na_trCl = Na_tr+ + Cl-; log_k -14
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A_Cl_tr
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NaCl_tr = Na+ + Cl_tr-; log_k -14
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A_Cs
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CsCl = Cs+ + Cl-; log_k -13
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EQUILIBRIUM_PHASES 17;
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A_Hto 0 0
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END
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# mixing factors...
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MIX 3; 4 6.6932e-04
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MIX 4; 5 1.9640e-04
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MIX 5; 6 1.5725e-04
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MIX 6; 7 1.8971e-04
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MIX 7; 8 2.2216e-04
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MIX 8; 9 2.5461e-04
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MIX 9; 10 2.8706e-04
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MIX 10; 11 3.1951e-04
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MIX 11; 12 3.5196e-04
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MIX 12; 13 3.8441e-04
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MIX 13; 14 4.1686e-04
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MIX 14; 15 4.4931e-04
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MIX 15; 16 7.7653e-04
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MIX 16; 17 4.2533e-03
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END
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TRANSPORT
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-warnings true
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-shifts 1120
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-flow diff; -cells 1; -bcon 1 2; -stag 15
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-time 1.5429e+03
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-multi_D true 2.5000e-09 1.5900e-01 0.0 9.9000e-01
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-interlayer_D false 0.001 0.0 1300
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-punch_fr 14; -punch_c 17
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USER_GRAPH 1 Example 21
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-chart_title " Hto Diffusion to Outer Cell"
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-plot_tsv_file ex21_Hto_rad.tsv
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-axis_scale x_axis 0 20
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-axis_titles "TIME, IN DAYS" "FLUX, IN MOL/M2/S" "ACCUMULATED MASS, IN MOL"
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-plot_concentration_vs time
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10 days = total_time / (3600 * 24)
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20 a = equi("A_Hto")
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30 IF get(1) = 0 AND total_time > 0 THEN put(total_time, 1)
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40 dt = get(1)
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50 plot_xy days - dt / (2 * 3600 * 24), (a - get(2)) / dt / 8.2988e-03, color = Green, symbol = None
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60 put(a, 2)
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70 plot_xy days, equi("A_Hto"), y_axis = 2, color = Red, symbol = None
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END
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TRANSPORT
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-shifts 0
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-punch_fr 2; -punch_c 3-17
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USER_GRAPH 1; -detach
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USER_GRAPH 5 Example 21
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-chart_title "Hto Concentration Profile: Filter1 | Clay | Filter2"
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-axis_scale x_axis 0 2.2220e+01
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-axis_scale y_axis 0 1.2e-9
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-axis_scale sy_axis 0 1.2e-9
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-axis_titles "DISTANCE, IN MILLIMETERS" "FREE PORE-WATER MOLALITY" "TOTAL MOLALITY"
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-headings Hto_free Hto_tot
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-plot_concentration_vs x
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-initial_solutions true
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10 IF cell_no = 3 THEN xval = 0 ELSE xval = get(14)
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20 IF (1 = 0 OR cell_no > 4) THEN GOTO 60
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30 IF (cell_no = 4) THEN xval = xval + 0.5 * 1.8000e-03
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40 IF (cell_no > 4 AND cell_no < 5) THEN xval = xval + 1.8000e-03
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50 GOTO 200
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60 IF (cell_no = 5) THEN xval = xval + 0.5 * 1.8000e-03 + 0.5 * 1.7109e-03
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70 IF (cell_no > 5 AND cell_no < 16) THEN xval = xval + 1.7109e-03 ELSE GOTO 90
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80 GOTO 200
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90 IF (cell_no = 16) THEN xval = xval + 0.5 * 1.7109e-03 + 0.5 * 1.6000e-03
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100 IF (cell_no > 16 AND cell_no <= 16) THEN xval = xval + 1.6000e-03
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110 IF (cell_no = 17) THEN xval = xval + 0.5 * 1.6000e-03
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200 y1 = TOT("Hto")
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210 plot_xy xval * 1e3, y1, color = Blue, symbol = Plus
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220 IF cell_no = 3 THEN put(y1, 15)
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230 IF (cell_no < 5 OR cell_no > 15) THEN GOTO 400
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240 y2 = SYS("Hto") / (tot("water") + edl("water"))
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250 REM y2 = y2 / 1.4281e+01# conc / kg solid
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260 plot_xy xval * 1e3, y2, symbol = Circle, y_axis = 2
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270 IF (cell_no > 6) THEN GOTO 400
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280 IF 1 THEN plot_xy 1.8000e+00, get(15), color = Black, symbol = None
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290 IF 1 THEN plot_xy 2.0620e+01, get(15), color = Black, symbol = None
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300 put(0, 15)
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400 put(xval, 14)
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END
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