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0642749631
All reactant structs have been removed. Tony's pressure uses mu in pressure term of log_k. Test cases run, discriminant check at 1e-8. Still want to optimize out some k_temp calls and checks for same T, P, mu. git-svn-id: svn://136.177.114.72/svn_GW/phreeqc3/trunk@6269 1feff8c3-07ed-0310-ac33-dd36852eb9cd
54 lines
7.5 KiB
Plaintext
54 lines
7.5 KiB
Plaintext
sim state soln dist_x time step pH pe temp si_anhydrite si_gypsum
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1 i_soln 1 -99 -99 -99 7 4 25.000 -999.9990 -999.9990
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1 react 1 -99 0 1 7.06676 10.6851 25.000 -0.2197 0.0000
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1 react 1 -99 0 2 7.05329 10.6154 26.000 -0.2157 0.0000
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1 react 1 -99 0 3 7.03993 10.5471 27.000 -0.2115 0.0000
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1 react 1 -99 0 4 7.02667 10.4783 28.000 -0.2071 0.0000
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1 react 1 -99 0 5 7.01353 10.4114 29.000 -0.2025 -0.0000
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1 react 1 -99 0 6 7.00051 10.3436 30.000 -0.1977 -0.0000
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1 react 1 -99 0 7 6.9876 10.2776 31.000 -0.1928 0.0000
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1 react 1 -99 0 8 6.97482 10.2104 32.000 -0.1877 0.0000
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1 react 1 -99 0 9 6.96217 10.144 33.000 -0.1824 0.0000
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1 react 1 -99 0 10 6.94965 10.2612 34.000 -0.1769 0.0000
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1 react 1 -99 0 11 6.93726 10.1958 35.000 -0.1713 0.0000
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1 react 1 -99 0 12 6.925 9.9496 36.000 -0.1655 0.0000
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1 react 1 -99 0 13 6.91288 9.90322 37.000 -0.1595 0.0000
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1 react 1 -99 0 14 6.90089 9.81939 38.000 -0.1533 0.0000
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1 react 1 -99 0 15 6.88905 9.75543 39.000 -0.1470 -0.0000
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1 react 1 -99 0 16 6.87734 9.69136 40.000 -0.1406 0.0000
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1 react 1 -99 0 17 6.86578 9.62869 41.000 -0.1340 0.0000
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1 react 1 -99 0 18 6.85435 9.56473 42.000 -0.1272 -0.0000
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1 react 1 -99 0 19 6.84307 9.50543 43.000 -0.1203 0.0000
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1 react 1 -99 0 20 6.83193 9.44024 44.000 -0.1132 -0.0000
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1 react 1 -99 0 21 6.82093 9.37907 45.000 -0.1060 -0.0000
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1 react 1 -99 0 22 6.81008 9.31609 46.000 -0.0986 -0.0000
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1 react 1 -99 0 23 6.79936 9.25732 47.000 -0.0911 -0.0000
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1 react 1 -99 0 24 6.78879 9.19569 48.000 -0.0835 -0.0000
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1 react 1 -99 0 25 6.77836 9.13296 49.000 -0.0757 0.0000
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1 react 1 -99 0 26 6.76807 9.25555 50.000 -0.0678 0.0000
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1 react 1 -99 0 27 6.75793 9.01324 51.000 -0.0597 -0.0000
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1 react 1 -99 0 28 6.74792 8.9526 52.000 -0.0515 0.0000
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1 react 1 -99 0 29 6.73806 9.07595 53.000 -0.0432 -0.0000
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1 react 1 -99 0 30 6.72833 8.83205 54.000 -0.0347 -0.0000
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1 react 1 -99 0 31 6.71874 8.77496 55.000 -0.0261 -0.0000
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1 react 1 -99 0 32 6.7093 8.71426 56.000 -0.0174 -0.0000
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1 react 1 -99 0 33 6.69999 8.65853 57.000 -0.0085 -0.0000
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1 react 1 -99 0 34 6.69076 8.59114 58.000 0.0000 -0.0004
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1 react 1 -99 0 35 6.68054 8.53585 59.000 0.0000 -0.0095
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1 react 1 -99 0 36 6.67043 8.47817 60.000 0.0000 -0.0187
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1 react 1 -99 0 37 6.66041 8.42318 61.000 0.0000 -0.0280
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1 react 1 -99 0 38 6.65049 8.36676 62.000 0.0000 -0.0375
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1 react 1 -99 0 39 6.64066 8.31043 63.000 0.0000 -0.0471
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1 react 1 -99 0 40 6.63093 8.25608 64.000 0.0000 -0.0567
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1 react 1 -99 0 41 6.62129 8.20171 65.000 0.0000 -0.0665
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1 react 1 -99 0 42 6.61175 8.14707 66.000 0.0000 -0.0764
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1 react 1 -99 0 43 6.6023 8.09216 67.000 0.0000 -0.0864
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1 react 1 -99 0 44 6.59294 8.03772 68.000 0.0000 -0.0966
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1 react 1 -99 0 45 6.58367 7.98434 69.000 0.0000 -0.1068
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1 react 1 -99 0 46 6.57449 7.93034 70.000 0.0000 -0.1171
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1 react 1 -99 0 47 6.5654 7.87842 71.000 0.0000 -0.1276
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1 react 1 -99 0 48 6.55641 7.82942 72.000 0.0000 -0.1381
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1 react 1 -99 0 49 6.5475 7.78559 73.000 0.0000 -0.1488
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1 react 1 -99 0 50 6.53867 7.75679 74.000 0.0000 -0.1595
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1 react 1 -99 0 51 6.52994 7.68817 75.000 0.0000 -0.1704
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