H2O Chem Phys Special Issue vol 258, pp 121-137 (2000) T=673K Case (a) g_OO(r) Bin no. r g(r) std. 1 0.0000000E+00 0.0000000E+00 0.0000000E+00 2 0.7500000E-02 0.0000000E+00 0.0000000E+00 3 0.3000000E-01 0.0000000E+00 0.0000000E+00 4 0.5999999E-01 0.0000000E+00 0.0000000E+00 5 0.9000000E-01 0.0000000E+00 0.0000000E+00 6 0.1200000 0.0000000E+00 0.0000000E+00 7 0.1500000 0.0000000E+00 0.0000000E+00 8 0.1800000 0.0000000E+00 0.0000000E+00 9 0.2100000 0.0000000E+00 0.0000000E+00 10 0.2400000 0.0000000E+00 0.0000000E+00 11 0.2700000 0.0000000E+00 0.0000000E+00 12 0.3000000 0.0000000E+00 0.0000000E+00 13 0.3300000 0.0000000E+00 0.0000000E+00 14 0.3600000 0.0000000E+00 0.0000000E+00 15 0.3900000 0.0000000E+00 0.0000000E+00 16 0.4200000 0.0000000E+00 0.0000000E+00 17 0.4500000 0.0000000E+00 0.0000000E+00 18 0.4800000 0.0000000E+00 0.0000000E+00 19 0.5100000 0.0000000E+00 0.0000000E+00 20 0.5400000 0.0000000E+00 0.0000000E+00 21 0.5699999 0.0000000E+00 0.0000000E+00 22 0.5999999 0.0000000E+00 0.0000000E+00 23 0.6299999 0.0000000E+00 0.0000000E+00 24 0.6599998 0.0000000E+00 0.0000000E+00 25 0.6899998 0.0000000E+00 0.0000000E+00 26 0.7199998 0.0000000E+00 0.0000000E+00 27 0.7499998 0.0000000E+00 0.0000000E+00 28 0.7799997 0.0000000E+00 0.0000000E+00 29 0.8099997 0.0000000E+00 0.0000000E+00 30 0.8399997 0.0000000E+00 0.0000000E+00 31 0.8699996 0.0000000E+00 0.0000000E+00 32 0.8999996 0.0000000E+00 0.0000000E+00 33 0.9299996 0.0000000E+00 0.0000000E+00 34 0.9599996 0.0000000E+00 0.0000000E+00 35 0.9899995 0.0000000E+00 0.0000000E+00 36 1.020000 0.0000000E+00 0.0000000E+00 37 1.049999 0.0000000E+00 0.0000000E+00 38 1.079999 0.0000000E+00 0.0000000E+00 39 1.109999 0.0000000E+00 0.0000000E+00 40 1.139999 0.0000000E+00 0.0000000E+00 41 1.169999 0.0000000E+00 0.0000000E+00 42 1.199999 0.0000000E+00 0.0000000E+00 43 1.229999 0.0000000E+00 0.0000000E+00 44 1.259999 0.0000000E+00 0.0000000E+00 45 1.289999 0.0000000E+00 0.0000000E+00 46 1.319999 0.0000000E+00 0.0000000E+00 47 1.349999 0.0000000E+00 0.0000000E+00 48 1.379999 0.0000000E+00 0.0000000E+00 49 1.409999 0.0000000E+00 0.0000000E+00 50 1.439999 0.0000000E+00 0.0000000E+00 51 1.469999 0.0000000E+00 0.0000000E+00 52 1.499999 0.0000000E+00 0.0000000E+00 53 1.529999 0.0000000E+00 0.0000000E+00 54 1.559999 0.0000000E+00 0.0000000E+00 55 1.589999 0.0000000E+00 0.0000000E+00 56 1.619999 0.0000000E+00 0.0000000E+00 57 1.649999 0.0000000E+00 0.0000000E+00 58 1.679999 0.0000000E+00 0.0000000E+00 59 1.709999 0.0000000E+00 0.0000000E+00 60 1.739999 0.0000000E+00 0.0000000E+00 61 1.769999 0.0000000E+00 0.0000000E+00 62 1.799999 0.0000000E+00 0.0000000E+00 63 1.829999 0.0000000E+00 0.0000000E+00 64 1.859999 0.0000000E+00 0.0000000E+00 65 1.889999 0.0000000E+00 0.0000000E+00 66 1.919999 0.0000000E+00 0.0000000E+00 67 1.949999 0.0000000E+00 0.0000000E+00 68 1.979999 0.0000000E+00 0.0000000E+00 69 2.009999 0.0000000E+00 0.0000000E+00 70 2.039999 0.0000000E+00 0.0000000E+00 71 2.069999 0.0000000E+00 0.0000000E+00 72 2.099998 0.0000000E+00 0.0000000E+00 73 2.129998 0.0000000E+00 0.0000000E+00 74 2.159998 0.0000000E+00 0.0000000E+00 75 2.189998 0.0000000E+00 0.0000000E+00 76 2.219998 0.0000000E+00 0.0000000E+00 77 2.249998 0.0000000E+00 0.0000000E+00 78 2.279998 0.0000000E+00 0.0000000E+00 79 2.309998 0.7989562E-04 0.2728880E-02 80 2.339998 0.3425707E-03 0.5569959E-02 81 2.369998 0.1381393E-02 0.1097785E-01 82 2.399998 0.4411123E-02 0.1948459E-01 83 2.429998 0.1137838E-01 0.3123810E-01 84 2.459998 0.2799563E-01 0.4846646E-01 85 2.489998 0.5775753E-01 0.6878009E-01 86 2.519998 0.1073992 0.9188416E-01 87 2.549998 0.1769654 0.1181976 88 2.579998 0.2668414 0.1393906 89 2.609998 0.3690870 0.1672286 90 2.639998 0.4733205 0.1851792 91 2.669998 0.5993806 0.2096825 92 2.699998 0.7107981 0.2237226 93 2.729998 0.8285589 0.2389138 94 2.759998 0.9279823 0.2490955 95 2.789998 1.019678 0.2485997 96 2.819998 1.116997 0.2689927 97 2.849998 1.182298 0.2669191 98 2.879998 1.271649 0.2756898 99 2.909998 1.305083 0.2756727 100 2.939998 1.358203 0.2755843 101 2.969998 1.414593 0.2825968 102 2.999998 1.449739 0.2782303 103 3.029998 1.493606 0.2876047 104 3.059998 1.524727 0.2839161 105 3.089998 1.554171 0.2875608 106 3.119998 1.574007 0.2851901 107 3.149997 1.571718 0.2777973 108 3.179997 1.571079 0.2867396 109 3.209997 1.590678 0.2814284 110 3.239997 1.577044 0.2737151 111 3.269997 1.583809 0.2771081 112 3.299997 1.580859 0.2737251 113 3.329997 1.553609 0.2620670 114 3.359997 1.533959 0.2576127 115 3.389997 1.499927 0.2531671 116 3.419997 1.473401 0.2474372 117 3.449997 1.434501 0.2468724 118 3.479997 1.406506 0.2370984 119 3.509997 1.369973 0.2332035 120 3.539997 1.323239 0.2297066 121 3.569997 1.280283 0.2182718 122 3.599997 1.237866 0.2166418 123 3.629997 1.217377 0.2103863 124 3.659997 1.172811 0.2005365 125 3.689997 1.138887 0.2043569 126 3.719997 1.111387 0.2000720 127 3.749997 1.078505 0.1914542 128 3.779997 1.051444 0.1900230 129 3.809997 1.019437 0.1856028 130 3.839997 1.000833 0.1850225 131 3.869997 0.9685140 0.1785543 132 3.899997 0.9623604 0.1751479 133 3.929997 0.9428593 0.1758250 134 3.959997 0.9245041 0.1713641 135 3.989997 0.9155256 0.1680298 136 4.019997 0.8956031 0.1644009 137 4.049997 0.8891571 0.1626458 138 4.079998 0.8813282 0.1612983 139 4.109998 0.8780702 0.1562254 140 4.139998 0.8762982 0.1548541 141 4.169998 0.8632849 0.1565206 142 4.199998 0.8751606 0.1559892 143 4.229999 0.8777633 0.1559334 144 4.259999 0.8793115 0.1551077 145 4.289999 0.8858433 0.1556781 146 4.319999 0.8892039 0.1549539 147 4.349999 0.8931959 0.1514056 148 4.380000 0.8999746 0.1538630 149 4.410000 0.9114654 0.1530193 150 4.440000 0.9078773 0.1507360 151 4.470000 0.9247419 0.1517106 152 4.500000 0.9213802 0.1487544 153 4.530001 0.9418685 0.1501507 154 4.560001 0.9376289 0.1450588 155 4.590001 0.9460452 0.1491427 156 4.620001 0.9637961 0.1459079 157 4.650002 0.9627800 0.1485722 158 4.680002 0.9701821 0.1489962 159 4.710002 0.9713929 0.1476645 160 4.740002 0.9813734 0.1451691 161 4.770002 0.9922200 0.1500901 162 4.800003 0.9944328 0.1454402 163 4.830003 0.9990040 0.1450978 164 4.860003 1.000785 0.1449866 165 4.890003 0.9947726 0.1432034 166 4.920003 1.010216 0.1432692 167 4.950004 1.005858 0.1424146 168 4.980004 1.005185 0.1393848 169 5.010004 1.002518 0.1414491 170 5.040004 0.9996367 0.1416070 171 5.070004 1.003333 0.1400078 172 5.100005 1.002858 0.1370397 173 5.130005 1.002428 0.1368595 174 5.160005 0.9951680 0.1404494 175 5.190005 1.001230 0.1356776 176 5.220006 0.9996049 0.1354026 177 5.250006 0.9952009 0.1329749 178 5.280006 0.9897813 0.1324595 179 5.310006 0.9987167 0.1333611 180 5.340006 0.9976097 0.1318047 181 5.370007 0.9938027 0.1305589 182 5.400007 0.9982839 0.1290350 183 5.430007 0.9936131 0.1267986 184 5.460007 1.001114 0.1288683 185 5.490007 0.9965308 0.1295234 186 5.520008 1.007882 0.1276904 187 5.550008 1.006240 0.1283121 188 5.580008 1.012110 0.1266645 189 5.610008 1.009294 0.1244418 190 5.640008 1.018785 0.1281555 191 5.670009 1.017304 0.1211789 192 5.700009 1.014643 0.1238638 193 5.730009 1.020740 0.1233840 194 5.760009 1.025019 0.1261987 195 5.790009 1.028821 0.1191136 196 5.820010 1.031228 0.1207522 197 5.850010 1.038623 0.1210829 198 5.880010 1.040553 0.1211523 199 5.910010 1.038662 0.1219120 200 5.940011 1.048344 0.1218470 201 5.970011 1.047694 0.1182054 202 6.000011 1.055449 0.1195776 203 6.030011 1.054265 0.1187302 204 6.060011 1.054796 0.1193311 205 6.090012 1.057214 0.1182846 206 6.120012 1.059305 0.1191116 207 6.150012 1.061619 0.1184583 208 6.180012 1.056776 0.1147076 209 6.210012 1.055519 0.1149542 210 6.240013 1.050480 0.1145043 211 6.270013 1.055381 0.1118740 212 6.300013 1.052705 0.1127935 213 6.330013 1.051815 0.1141117 214 6.360013 1.051344 0.1147949 215 6.390014 1.043012 0.1094311 216 6.420014 1.041349 0.1095465 217 6.450014 1.037246 0.1116836 218 6.480014 1.035230 0.1080553 219 6.510015 1.025721 0.1074113 220 6.540015 1.026722 0.1119283 221 6.570015 1.029435 0.1065382 222 6.600015 1.015700 0.1057842 223 6.630015 1.010788 0.1077327 224 6.660016 1.008418 0.1053155 225 6.690016 1.000873 0.1026425 226 6.720016 0.9955283 0.1028481 227 6.750016 0.9914160 0.1032625 228 6.780016 0.9901413 0.1043618 229 6.810017 0.9830780 0.9955371E-01 230 6.840017 0.9845953 0.1027197 231 6.870017 0.9754124 0.1009178 232 6.900017 0.9707409 0.9722868E-01 233 6.930017 0.9690124 0.9849947E-01 234 6.960018 0.9665166 0.9828412E-01 235 6.990018 0.9633229 0.9960608E-01 236 7.020018 0.9573958 0.9998564E-01 237 7.050018 0.9560490 0.9649919E-01 238 7.080019 0.9622179 0.9666581E-01 239 7.110019 0.9568948 0.9557755E-01 240 7.140019 0.9577174 0.9726913E-01 241 7.170019 0.9547384 0.9422247E-01 242 7.200019 0.9574653 0.9354474E-01 243 7.230020 0.9559200 0.9545649E-01 244 7.260020 0.9585505 0.9412246E-01 245 7.290020 0.9615926 0.9501965E-01 246 7.320020 0.9591616 0.9566357E-01 247 7.350020 0.9652895 0.9314789E-01 248 7.380021 0.9657171 0.9218208E-01 249 7.410021 0.9641601 0.9422025E-01 250 7.440021 0.9693288 0.9289286E-01 251 7.470021 0.9751207 0.9404169E-01 252 7.500021 0.9727764 0.9327482E-01 253 7.530022 0.9766043 0.9098293E-01 254 7.560022 0.9769303 0.8930643E-01 255 7.590022 0.9842941 0.9265225E-01 256 7.620022 0.9855815 0.9312773E-01 257 7.650023 0.9882866 0.9044117E-01 258 7.680023 0.9912262 0.8909394E-01 259 7.710023 0.9997751 0.8994155E-01 260 7.740023 1.001881 0.8962455E-01 261 7.770023 1.001802 0.9052845E-01 262 7.800024 1.006942 0.9213907E-01 263 7.830024 1.005324 0.8988819E-01 264 7.860024 1.007603 0.8750253E-01 265 7.890024 1.009592 0.8841868E-01 266 7.920024 1.011119 0.8852311E-01 267 7.950025 1.009744 0.8925736E-01 268 7.980025 1.010867 0.8926804E-01 269 8.010024 1.013455 0.8833776E-01 270 8.040024 1.010576 0.8955003E-01 271 8.070024 1.011536 0.8817432E-01 272 8.100023 1.011549 0.8639405E-01 273 8.130023 1.011718 0.8565823E-01 274 8.160023 1.009575 0.8683448E-01 275 8.190022 1.009398 0.8679465E-01 276 8.220022 1.006313 0.8474036E-01 277 8.250022 1.009700 0.8639888E-01 278 8.280022 1.002854 0.8379822E-01 279 8.310021 1.004623 0.8485353E-01 280 8.340021 1.004630 0.8387075E-01 281 8.370021 1.002849 0.8250798E-01 282 8.400021 0.9984833 0.8338787E-01 283 8.430020 0.9988881 0.8168355E-01 284 8.460020 0.9965014 0.8303653E-01 285 8.490020 0.9972523 0.8304909E-01 286 8.520020 0.9961353 0.8365406E-01 287 8.550019 0.9958093 0.8209118E-01 288 8.580019 0.9887466 0.8116675E-01 289 8.610019 0.9931290 0.8308425E-01 290 8.640018 0.9907376 0.7932204E-01 291 8.670018 0.9950250 0.8172551E-01 292 8.700018 0.9942934 0.8008222E-01 293 8.730018 0.9943962 0.8129883E-01 294 8.760017 0.9925381 0.8063555E-01 295 8.790017 0.9946124 0.7970285E-01 296 8.820017 0.9953858 0.7925852E-01 297 8.850017 0.9974362 0.7944593E-01 298 8.880016 0.9946113 0.8016442E-01 299 8.910016 0.9978865 0.7917575E-01 300 8.940016 0.9977831 0.7871103E-01 301 8.970016 0.9982527 0.7839879E-01 302 9.000015 1.003096 0.7813797E-01 303 9.030015 1.002282 0.7824393E-01 304 9.060015 1.006329 0.7760600E-01 305 9.090014 1.006257 0.7703478E-01 306 9.120014 1.008446 0.7921527E-01 307 9.150014 1.011403 0.7748610E-01 308 9.180014 1.009019 0.7560007E-01 309 9.210013 1.010798 0.7655746E-01 310 9.240013 1.015293 0.7593519E-01 311 9.270013 1.014496 0.7563318E-01 312 9.300013 1.015353 0.7639534E-01 313 9.330012 1.019275 0.7781846E-01 314 9.360012 1.018300 0.7531174E-01 315 9.390012 1.017271 0.7589986E-01 316 9.420012 1.019279 0.7491339E-01 317 9.450011 1.020408 0.7596894E-01 318 9.480011 1.023227 0.7398146E-01 319 9.510011 1.019877 0.7361235E-01 320 9.540010 1.022335 0.7354835E-01 321 9.570010 1.020858 0.7521196E-01 322 9.600010 1.022971 0.7384840E-01 323 9.630010 1.016232 0.7340152E-01 324 9.660009 1.020319 0.7393713E-01 325 9.690009 1.020992 0.7087314E-01 326 9.720009 1.020347 0.7231757E-01 327 9.750009 1.019611 0.7304580E-01 328 9.780008 1.016723 0.7129659E-01 329 9.810008 1.019595 0.7130662E-01 330 9.840008 1.016933 0.7117024E-01 331 9.870008 1.015651 0.7233158E-01 332 9.900007 1.013211 0.7017589E-01 333 9.930007 1.013348 0.7183545E-01 334 9.960007 1.014331 0.7006368E-01 335 9.990006 1.009996 0.6799130E-01 336 10.02001 1.008681 0.6821360E-01 337 10.05001 1.008488 0.6936859E-01 338 10.08001 1.004823 0.7059338E-01 339 10.11001 1.010311 0.6912931E-01 340 10.14001 1.005231 0.6840906E-01 341 10.17000 1.003620 0.6941069E-01 342 10.20000 0.9996145 0.7033030E-01 343 10.23000 0.9999346 0.6911121E-01 344 10.26000 0.9983538 0.6874672E-01 345 10.29000 0.9996312 0.6814454E-01 346 10.32000 0.9956515 0.6639234E-01 347 10.35000 0.9967263 0.6703339E-01 348 10.38000 0.9959975 0.6831751E-01 349 10.41000 0.9947910 0.6685308E-01 350 10.44000 0.9930573 0.6710760E-01 351 10.47000 0.9954055 0.6500196E-01 352 10.50000 0.9927961 0.6516909E-01 353 10.53000 0.9924487 0.6675316E-01 354 10.56000 0.9898710 0.6570604E-01 355 10.59000 0.9892446 0.6475160E-01 356 10.62000 0.9968762 0.6340704E-01 357 10.65000 0.9924128 0.6607828E-01 358 10.68000 0.9955680 0.6646681E-01 359 10.71000 0.9925960 0.6384452E-01 360 10.74000 0.9930929 0.6589083E-01 361 10.77000 0.9913605 0.6483577E-01 362 10.80000 0.9935480 0.6319093E-01 363 10.83000 0.9925688 0.6420667E-01 364 10.86000 0.9928303 0.6504045E-01 365 10.89000 0.9911527 0.6420527E-01 366 10.92000 0.9945770 0.6447577E-01 367 10.95000 0.9936148 0.6628182E-01 368 10.98000 0.9945562 0.6336848E-01 369 11.01000 0.9945709 0.6368936E-01 370 11.04000 0.9935445 0.6353616E-01 371 11.07000 0.9960415 0.6306063E-01 372 11.10000 0.9937255 0.6129291E-01 373 11.13000 0.9929422 0.6442029E-01 374 11.16000 0.9937822 0.6177626E-01 375 11.19000 0.9975065 0.6197278E-01 376 11.22000 0.9937644 0.6219647E-01 377 11.25000 0.9949365 0.6140319E-01 378 11.27999 0.9965299 0.6239501E-01 379 11.30999 0.9950325 0.6109421E-01 380 11.33999 0.9953098 0.6125643E-01 381 11.36999 0.9970298 0.6136823E-01 382 11.39999 0.9992480 0.6172511E-01 383 11.42999 0.9976343 0.6115857E-01 384 11.45999 1.000160 0.6118634E-01 385 11.48999 1.000888 0.6028148E-01 386 11.51999 0.9976434 0.6095551E-01 387 11.54999 0.9995008 0.6108885E-01 388 11.57999 1.002988 0.6120192E-01 389 11.60999 1.001983 0.6041087E-01 390 11.63999 0.9999638 0.5858561E-01 391 11.66999 1.002392 0.6057050E-01 392 11.69999 1.000834 0.5867609E-01 393 11.72999 0.9980378 0.5797402E-01 394 11.75999 0.9993504 0.6004619E-01 395 11.78999 1.000278 0.6002881E-01 396 11.81999 1.001001 0.6024291E-01 397 11.84999 1.004126 0.5909615E-01 398 11.87999 1.001090 0.5826221E-01 399 11.90999 1.001623 0.5860901E-01 400 11.93999 1.003798 0.5781341E-01 401 11.96999 1.003812 0.6078268E-01 402 11.99999 1.001308 0.6003676E-01 403 12.02999 1.002252 0.5802026E-01 404 12.05999 1.003657 0.5763167E-01 405 12.08999 1.005554 0.5821820E-01 406 12.11999 1.003594 0.5762339E-01 407 12.14999 1.008425 0.5775461E-01 408 12.17999 1.004752 0.5789274E-01 409 12.20999 1.006721 0.5816289E-01 410 12.23999 1.003048 0.5711847E-01 411 12.26999 1.007664 0.5676991E-01 412 12.29999 1.008626 0.5765855E-01 413 12.32999 1.009403 0.5672580E-01 414 12.35999 1.008379 0.5721961E-01 415 12.38999 1.008729 0.5720189E-01 416 12.41998 1.006629 0.5675416E-01 417 12.44998 1.007505 0.5637693E-01 418 12.47998 1.007890 0.5678356E-01 419 12.50998 1.007373 0.5633674E-01 420 12.53998 1.004258 0.5542046E-01 421 12.56998 1.006944 0.5555366E-01 422 12.59998 1.007178 0.5624674E-01 423 12.62998 1.006583 0.5486052E-01 424 12.65998 1.008390 0.5569404E-01 425 12.68998 1.006842 0.5536235E-01 426 12.71998 1.005762 0.5478442E-01 427 12.74998 1.007284 0.5546669E-01 428 12.77998 1.004120 0.5444828E-01 429 12.80998 1.004817 0.5346067E-01 430 12.83998 1.008950 0.5301169E-01 431 12.86998 1.005842 0.5624356E-01 432 12.89998 1.005475 0.5546131E-01 433 12.92998 1.003963 0.5376861E-01 434 12.95998 1.006954 0.5344952E-01 435 12.98998 1.005106 0.5333900E-01 436 13.01998 1.005912 0.5431237E-01 437 13.04998 1.001109 0.5317672E-01 438 13.07998 1.001121 0.5388378E-01 439 13.10998 1.006708 0.5337475E-01 440 13.13998 1.001832 0.5165868E-01 441 13.16998 1.003514 0.5336023E-01 442 13.19998 1.002985 0.5337028E-01 443 13.22998 1.004353 0.5360763E-01 444 13.25998 1.003737 0.5139146E-01 445 13.28998 0.9999098 0.5229399E-01 446 13.31998 1.002397 0.5357538E-01 447 13.34998 1.002560 0.5212159E-01 448 13.37998 1.000713 0.5284277E-01 449 13.40998 1.001133 0.5178084E-01 450 13.43998 0.9988158 0.5132531E-01 451 13.46998 1.001689 0.5300607E-01 452 13.49998 1.002039 0.5222556E-01 453 13.52997 1.002106 0.5097923E-01 454 13.55997 1.000664 0.5163791E-01 455 13.58997 0.9999961 0.5064609E-01 456 13.61997 0.9990337 0.5216160E-01 457 13.64997 1.001292 0.5257250E-01 458 13.67997 1.001634 0.5144015E-01 459 13.70997 0.9993810 0.5071195E-01 460 13.73997 1.002418 0.5032614E-01 461 13.76997 1.001200 0.5096052E-01 462 13.79997 0.9993023 0.5176587E-01 463 13.82997 0.9983446 0.5003989E-01 464 13.85997 1.000637 0.5167022E-01 465 13.88997 1.001111 0.5152697E-01 466 13.91997 1.002119 0.5018738E-01 467 13.94997 1.001234 0.5015887E-01 468 13.97997 1.000103 0.4981307E-01 469 14.00997 1.001562 0.5041253E-01 470 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