# Sqw data file for Isotropic_Sqw (generated 30-Mar-2010 11:46:32) # liquid Rb: incoherent dynamic structure factor "Rb_liq_inc.sqw" # Trajectory Classical molecular dynamics: 512 atoms for 101.41 ps. box=36.7 Angs. Processed by nMoldyn. # Data by V. Hugouvieux, PhD (2004), classical MD with 520 atoms. # potential by Kahl, Phys. Rev. A 46 (1992) 3255. # E. Farhi, V. Hugouvieux, M.R. Johnson, W. Kob, Journal of Computational Physics 228 (2009) 5251-5261 # # Physical parameters: # V_rho 0.0103 atom density per Angs^3 # density 1.459 in [g/cm^3] # weight 85.47 in [g/mol] # sigma_abs 0.38 absorption scattering cross section in [barn] # sigma_coh 6.32 coherent scattering cross section in [barn] # sigma_inc 0.5 incoherent scattering cross section in [barn] # Temperature 350 in [K] # v_sound 1300 in [m/s] # # WAVEVECTOR vector of m=100 values in Angstroem-1: q 0.1 0.2 0.3 0.4 0.5 0.6 0.7 0.8 0.9 1 1.1 1.2 1.3 1.4 1.5 1.6 1.7 1.8 1.9 2 2.1 2.2 2.3 2.4 2.5 2.6 2.7 2.8 2.9 3 3.1 3.2 3.3 3.4 3.5 3.6 3.7 3.8 3.9 4 4.1 4.2 4.3 4.4 4.5 4.6 4.7 4.8 4.9 5 5.1 5.2 5.3 5.4 5.5 5.6 5.7 5.8 5.9 6 6.1 6.2 6.3 6.4 6.5 6.6 6.7 6.8 6.9 7 7.1 7.2 7.3 7.4 7.5 7.6 7.7 7.8 7.9 8 8.1 8.2 8.3 8.4 8.5 8.6 8.7 8.8 8.9 9 9.1 9.2 9.3 9.4 9.5 9.6 9.7 9.8 9.9 10 # ENERGY vector of n=5001 values in meV: w 0 0.0203698 0.0407396 0.0611094 0.0814792 0.101849 0.122219 0.142589 0.162958 0.183328 0.203698 0.224068 0.244438 0.264808 0.285177 0.305547 0.325917 0.346287 0.366657 0.387026 0.407396 0.427766 0.448136 0.468506 0.488875 0.509245 0.529615 0.549985 0.570355 0.590725 0.611094 0.631464 0.651834 0.672204 0.692574 0.712943 0.733313 0.753683 0.774053 0.794423 0.814792 0.835162 0.855532 0.875902 0.896272 0.916641 0.937011 0.957381 0.977751 0.998121 1.01849 1.03886 1.05923 1.0796 1.09997 1.12034 1.14071 1.16108 1.18145 1.20182 1.22219 1.24256 1.26293 1.2833 1.30367 1.32404 1.34441 1.36478 1.38515 1.40552 1.42589 1.44626 1.46663 1.487 1.50737 1.52774 1.54811 1.56848 1.58885 1.60922 1.62958 1.64995 1.67032 1.69069 1.71106 1.73143 1.7518 1.77217 1.79254 1.81291 1.83328 1.85365 1.87402 1.89439 1.91476 1.93513 1.9555 1.97587 1.99624 2.01661 2.03698 2.05735 2.07772 2.09809 2.11846 2.13883 2.1592 2.17957 2.19994 2.22031 2.24068 2.26105 2.28142 2.30179 2.32216 2.34253 2.3629 2.38327 2.40364 2.42401 2.44438 2.46475 2.48512 2.50549 2.52586 2.54623 2.5666 2.58697 2.60734 2.62771 2.64808 2.66845 2.68882 2.70918 2.72955 2.74992 2.77029 2.79066 2.81103 2.8314 2.85177 2.87214 2.89251 2.91288 2.93325 2.95362 2.97399 2.99436 3.01473 3.0351 3.05547 3.07584 3.09621 3.11658 3.13695 3.15732 3.17769 3.19806 3.21843 3.2388 3.25917 3.27954 3.29991 3.32028 3.34065 3.36102 3.38139 3.40176 3.42213 3.4425 3.46287 3.48324 3.50361 3.52398 3.54435 3.56472 3.58509 3.60546 3.62583 3.6462 3.66657 3.68694 3.70731 3.72768 3.74805 3.76842 3.78878 3.80915 3.82952 3.84989 3.87026 3.89063 3.911 3.93137 3.95174 3.97211 3.99248 4.01285 4.03322 4.05359 4.07396 4.09433 4.1147 4.13507 4.15544 4.17581 4.19618 4.21655 4.23692 4.25729 4.27766 4.29803 4.3184 4.33877 4.35914 4.37951 4.39988 4.42025 4.44062 4.46099 4.48136 4.50173 4.5221 4.54247 4.56284 4.58321 4.60358 4.62395 4.64432 4.66469 4.68506 4.70543 4.7258 4.74617 4.76654 4.78691 4.80728 4.82765 4.84802 4.86838 4.88875 4.90912 4.92949 4.94986 4.97023 4.9906 5.01097 5.03134 5.05171 5.07208 5.09245 5.11282 5.13319 5.15356 5.17393 5.1943 5.21467 5.23504 5.25541 5.27578 5.29615 5.31652 5.33689 5.35726 5.37763 5.398 5.41837 5.43874 5.45911 5.47948 5.49985 5.52022 5.54059 5.56096 5.58133 5.6017 5.62207 5.64244 5.66281 5.68318 5.70355 5.72392 5.74429 5.76466 5.78503 5.8054 5.82577 5.84614 5.86651 5.88688 5.90725 5.92761 5.94798 5.96835 5.98872 6.00909 6.02946 6.04983 6.0702 6.09057 6.11094 6.13131 6.15168 6.17205 6.19242 6.21279 6.23316 6.25353 6.2739 6.29427 6.31464 6.33501 6.35538 6.37575 6.39612 6.41649 6.43686 6.45723 6.4776 6.49797 6.51834 6.53871 6.55908 6.57945 6.59982 6.62019 6.64056 6.66093 6.6813 6.70167 6.72204 6.74241 6.76278 6.78315 6.80352 6.82389 6.84426 6.86463 6.885 6.90537 6.92574 6.94611 6.96648 6.98685 7.00721 7.02758 7.04795 7.06832 7.08869 7.10906 7.12943 7.1498 7.17017 7.19054 7.21091 7.23128 7.25165 7.27202 7.29239 7.31276 7.33313 7.3535 7.37387 7.39424 7.41461 7.43498 7.45535 7.47572 7.49609 7.51646 7.53683 7.5572 7.57757 7.59794 7.61831 7.63868 7.65905 7.67942 7.69979 7.72016 7.74053 7.7609 7.78127 7.80164 7.82201 7.84238 7.86275 7.88312 7.90349 7.92386 7.94423 7.9646 7.98497 8.00534 8.02571 8.04608 8.06645 8.08681 8.10718 8.12755 8.14792 8.16829 8.18866 8.20903 8.2294 8.24977 8.27014 8.29051 8.31088 8.33125 8.35162 8.37199 8.39236 8.41273 8.4331 8.45347 8.47384 8.49421 8.51458 8.53495 8.55532 8.57569 8.59606 8.61643 8.6368 8.65717 8.67754 8.69791 8.71828 8.73865 8.75902 8.77939 8.79976 8.82013 8.8405 8.86087 8.88124 8.90161 8.92198 8.94235 8.96272 8.98309 9.00346 9.02383 9.0442 9.06457 9.08494 9.10531 9.12568 9.14605 9.16641 9.18678 9.20715 9.22752 9.24789 9.26826 9.28863 9.309 9.32937 9.34974 9.37011 9.39048 9.41085 9.43122 9.45159 9.47196 9.49233 9.5127 9.53307 9.55344 9.57381 9.59418 9.61455 9.63492 9.65529 9.67566 9.69603 9.7164 9.73677 9.75714 9.77751 9.79788 9.81825 9.83862 9.85899 9.87936 9.89973 9.9201 9.94047 9.96084 9.98121 10.0016 10.0219 10.0423 10.0627 10.0831 10.1034 10.1238 10.1442 10.1645 10.1849 10.2053 10.2256 10.246 10.2664 10.2868 10.3071 10.3275 10.3479 10.3682 10.3886 10.409 10.4293 10.4497 10.4701 10.4905 10.5108 10.5312 10.5516 10.5719 10.5923 10.6127 10.633 10.6534 10.6738 10.6942 10.7145 10.7349 10.7553 10.7756 10.796 10.8164 10.8367 10.8571 10.8775 10.8978 10.9182 10.9386 10.959 10.9793 10.9997 11.0201 11.0404 11.0608 11.0812 11.1015 11.1219 11.1423 11.1627 11.183 11.2034 11.2238 11.2441 11.2645 11.2849 11.3052 11.3256 11.346 11.3664 11.3867 11.4071 11.4275 11.4478 11.4682 11.4886 11.5089 11.5293 11.5497 11.5701 11.5904 11.6108 11.6312 11.6515 11.6719 11.6923 11.7126 11.733 11.7534 11.7738 11.7941 11.8145 11.8349 11.8552 11.8756 11.896 11.9163 11.9367 11.9571 11.9774 11.9978 12.0182 12.0386 12.0589 12.0793 12.0997 12.12 12.1404 12.1608 12.1811 12.2015 12.2219 12.2423 12.2626 12.283 12.3034 12.3237 12.3441 12.3645 12.3848 12.4052 12.4256 12.446 12.4663 12.4867 12.5071 12.5274 12.5478 12.5682 12.5885 12.6089 12.6293 12.6497 12.67 12.6904 12.7108 12.7311 12.7515 12.7719 12.7922 12.8126 12.833 12.8534 12.8737 12.8941 12.9145 12.9348 12.9552 12.9756 12.9959 13.0163 13.0367 13.057 13.0774 13.0978 13.1182 13.1385 13.1589 13.1793 13.1996 13.22 13.2404 13.2607 13.2811 13.3015 13.3219 13.3422 13.3626 13.383 13.4033 13.4237 13.4441 13.4644 13.4848 13.5052 13.5256 13.5459 13.5663 13.5867 13.607 13.6274 13.6478 13.6681 13.6885 13.7089 13.7293 13.7496 13.77 13.7904 13.8107 13.8311 13.8515 13.8718 13.8922 13.9126 13.933 13.9533 13.9737 13.9941 14.0144 14.0348 14.0552 14.0755 14.0959 14.1163 14.1366 14.157 14.1774 14.1978 14.2181 14.2385 14.2589 14.2792 14.2996 14.32 14.3403 14.3607 14.3811 14.4015 14.4218 14.4422 14.4626 14.4829 14.5033 14.5237 14.544 14.5644 14.5848 14.6052 14.6255 14.6459 14.6663 14.6866 14.707 14.7274 14.7477 14.7681 14.7885 14.8089 14.8292 14.8496 14.87 14.8903 14.9107 14.9311 14.9514 14.9718 14.9922 15.0126 15.0329 15.0533 15.0737 15.094 15.1144 15.1348 15.1551 15.1755 15.1959 15.2162 15.2366 15.257 15.2774 15.2977 15.3181 15.3385 15.3588 15.3792 15.3996 15.4199 15.4403 15.4607 15.4811 15.5014 15.5218 15.5422 15.5625 15.5829 15.6033 15.6236 15.644 15.6644 15.6848 15.7051 15.7255 15.7459 15.7662 15.7866 15.807 15.8273 15.8477 15.8681 15.8885 15.9088 15.9292 15.9496 15.9699 15.9903 16.0107 16.031 16.0514 16.0718 16.0922 16.1125 16.1329 16.1533 16.1736 16.194 16.2144 16.2347 16.2551 16.2755 16.2958 16.3162 16.3366 16.357 16.3773 16.3977 16.4181 16.4384 16.4588 16.4792 16.4995 16.5199 16.5403 16.5607 16.581 16.6014 16.6218 16.6421 16.6625 16.6829 16.7032 16.7236 16.744 16.7644 16.7847 16.8051 16.8255 16.8458 16.8662 16.8866 16.9069 16.9273 16.9477 16.9681 16.9884 17.0088 17.0292 17.0495 17.0699 17.0903 17.1106 17.131 17.1514 17.1718 17.1921 17.2125 17.2329 17.2532 17.2736 17.294 17.3143 17.3347 17.3551 17.3754 17.3958 17.4162 17.4366 17.4569 17.4773 17.4977 17.518 17.5384 17.5588 17.5791 17.5995 17.6199 17.6403 17.6606 17.681 17.7014 17.7217 17.7421 17.7625 17.7828 17.8032 17.8236 17.844 17.8643 17.8847 17.9051 17.9254 17.9458 17.9662 17.9865 18.0069 18.0273 18.0477 18.068 18.0884 18.1088 18.1291 18.1495 18.1699 18.1902 18.2106 18.231 18.2514 18.2717 18.2921 18.3125 18.3328 18.3532 18.3736 18.3939 18.4143 18.4347 18.455 18.4754 18.4958 18.5162 18.5365 18.5569 18.5773 18.5976 18.618 18.6384 18.6587 18.6791 18.6995 18.7199 18.7402 18.7606 18.781 18.8013 18.8217 18.8421 18.8624 18.8828 18.9032 18.9236 18.9439 18.9643 18.9847 19.005 19.0254 19.0458 19.0661 19.0865 19.1069 19.1273 19.1476 19.168 19.1884 19.2087 19.2291 19.2495 19.2698 19.2902 19.3106 19.331 19.3513 19.3717 19.3921 19.4124 19.4328 19.4532 19.4735 19.4939 19.5143 19.5346 19.555 19.5754 19.5958 19.6161 19.6365 19.6569 19.6772 19.6976 19.718 19.7383 19.7587 19.7791 19.7995 19.8198 19.8402 19.8606 19.8809 19.9013 19.9217 19.942 19.9624 19.9828 20.0032 20.0235 20.0439 20.0643 20.0846 20.105 20.1254 20.1457 20.1661 20.1865 20.2069 20.2272 20.2476 20.268 20.2883 20.3087 20.3291 20.3494 20.3698 20.3902 20.4106 20.4309 20.4513 20.4717 20.492 20.5124 20.5328 20.5531 20.5735 20.5939 20.6142 20.6346 20.655 20.6754 20.6957 20.7161 20.7365 20.7568 20.7772 20.7976 20.8179 20.8383 20.8587 20.8791 20.8994 20.9198 20.9402 20.9605 20.9809 21.0013 21.0216 21.042 21.0624 21.0828 21.1031 21.1235 21.1439 21.1642 21.1846 21.205 21.2253 21.2457 21.2661 21.2865 21.3068 21.3272 21.3476 21.3679 21.3883 21.4087 21.429 21.4494 21.4698 21.4902 21.5105 21.5309 21.5513 21.5716 21.592 21.6124 21.6327 21.6531 21.6735 21.6938 21.7142 21.7346 21.755 21.7753 21.7957 21.8161 21.8364 21.8568 21.8772 21.8975 21.9179 21.9383 21.9587 21.979 21.9994 22.0198 22.0401 22.0605 22.0809 22.1012 22.1216 22.142 22.1624 22.1827 22.2031 22.2235 22.2438 22.2642 22.2846 22.3049 22.3253 22.3457 22.3661 22.3864 22.4068 22.4272 22.4475 22.4679 22.4883 22.5086 22.529 22.5494 22.5698 22.5901 22.6105 22.6309 22.6512 22.6716 22.692 22.7123 22.7327 22.7531 22.7734 22.7938 22.8142 22.8346 22.8549 22.8753 22.8957 22.916 22.9364 22.9568 22.9771 22.9975 23.0179 23.0383 23.0586 23.079 23.0994 23.1197 23.1401 23.1605 23.1808 23.2012 23.2216 23.242 23.2623 23.2827 23.3031 23.3234 23.3438 23.3642 23.3845 23.4049 23.4253 23.4457 23.466 23.4864 23.5068 23.5271 23.5475 23.5679 23.5882 23.6086 23.629 23.6494 23.6697 23.6901 23.7105 23.7308 23.7512 23.7716 23.7919 23.8123 23.8327 23.853 23.8734 23.8938 23.9142 23.9345 23.9549 23.9753 23.9956 24.016 24.0364 24.0567 24.0771 24.0975 24.1179 24.1382 24.1586 24.179 24.1993 24.2197 24.2401 24.2604 24.2808 24.3012 24.3216 24.3419 24.3623 24.3827 24.403 24.4234 24.4438 24.4641 24.4845 24.5049 24.5253 24.5456 24.566 24.5864 24.6067 24.6271 24.6475 24.6678 24.6882 24.7086 24.729 24.7493 24.7697 24.7901 24.8104 24.8308 24.8512 24.8715 24.8919 24.9123 24.9326 24.953 24.9734 24.9938 25.0141 25.0345 25.0549 25.0752 25.0956 25.116 25.1363 25.1567 25.1771 25.1975 25.2178 25.2382 25.2586 25.2789 25.2993 25.3197 25.34 25.3604 25.3808 25.4012 25.4215 25.4419 25.4623 25.4826 25.503 25.5234 25.5437 25.5641 25.5845 25.6049 25.6252 25.6456 25.666 25.6863 25.7067 25.7271 25.7474 25.7678 25.7882 25.8086 25.8289 25.8493 25.8697 25.89 25.9104 25.9308 25.9511 25.9715 25.9919 26.0122 26.0326 26.053 26.0734 26.0937 26.1141 26.1345 26.1548 26.1752 26.1956 26.2159 26.2363 26.2567 26.2771 26.2974 26.3178 26.3382 26.3585 26.3789 26.3993 26.4196 26.44 26.4604 26.4808 26.5011 26.5215 26.5419 26.5622 26.5826 26.603 26.6233 26.6437 26.6641 26.6845 26.7048 26.7252 26.7456 26.7659 26.7863 26.8067 26.827 26.8474 26.8678 26.8882 26.9085 26.9289 26.9493 26.9696 26.99 27.0104 27.0307 27.0511 27.0715 27.0918 27.1122 27.1326 27.153 27.1733 27.1937 27.2141 27.2344 27.2548 27.2752 27.2955 27.3159 27.3363 27.3567 27.377 27.3974 27.4178 27.4381 27.4585 27.4789 27.4992 27.5196 27.54 27.5604 27.5807 27.6011 27.6215 27.6418 27.6622 27.6826 27.7029 27.7233 27.7437 27.7641 27.7844 27.8048 27.8252 27.8455 27.8659 27.8863 27.9066 27.927 27.9474 27.9678 27.9881 28.0085 28.0289 28.0492 28.0696 28.09 28.1103 28.1307 28.1511 28.1714 28.1918 28.2122 28.2326 28.2529 28.2733 28.2937 28.314 28.3344 28.3548 28.3751 28.3955 28.4159 28.4363 28.4566 28.477 28.4974 28.5177 28.5381 28.5585 28.5788 28.5992 28.6196 28.64 28.6603 28.6807 28.7011 28.7214 28.7418 28.7622 28.7825 28.8029 28.8233 28.8437 28.864 28.8844 28.9048 28.9251 28.9455 28.9659 28.9862 29.0066 29.027 29.0474 29.0677 29.0881 29.1085 29.1288 29.1492 29.1696 29.1899 29.2103 29.2307 29.251 29.2714 29.2918 29.3122 29.3325 29.3529 29.3733 29.3936 29.414 29.4344 29.4547 29.4751 29.4955 29.5159 29.5362 29.5566 29.577 29.5973 29.6177 29.6381 29.6584 29.6788 29.6992 29.7196 29.7399 29.7603 29.7807 29.801 29.8214 29.8418 29.8621 29.8825 29.9029 29.9233 29.9436 29.964 29.9844 30.0047 30.0251 30.0455 30.0658 30.0862 30.1066 30.127 30.1473 30.1677 30.1881 30.2084 30.2288 30.2492 30.2695 30.2899 30.3103 30.3306 30.351 30.3714 30.3918 30.4121 30.4325 30.4529 30.4732 30.4936 30.514 30.5343 30.5547 30.5751 30.5955 30.6158 30.6362 30.6566 30.6769 30.6973 30.7177 30.738 30.7584 30.7788 30.7992 30.8195 30.8399 30.8603 30.8806 30.901 30.9214 30.9417 30.9621 30.9825 31.0029 31.0232 31.0436 31.064 31.0843 31.1047 31.1251 31.1454 31.1658 31.1862 31.2066 31.2269 31.2473 31.2677 31.288 31.3084 31.3288 31.3491 31.3695 31.3899 31.4102 31.4306 31.451 31.4714 31.4917 31.5121 31.5325 31.5528 31.5732 31.5936 31.6139 31.6343 31.6547 31.6751 31.6954 31.7158 31.7362 31.7565 31.7769 31.7973 31.8176 31.838 31.8584 31.8788 31.8991 31.9195 31.9399 31.9602 31.9806 32.001 32.0213 32.0417 32.0621 32.0825 32.1028 32.1232 32.1436 32.1639 32.1843 32.2047 32.225 32.2454 32.2658 32.2862 32.3065 32.3269 32.3473 32.3676 32.388 32.4084 32.4287 32.4491 32.4695 32.4898 32.5102 32.5306 32.551 32.5713 32.5917 32.6121 32.6324 32.6528 32.6732 32.6935 32.7139 32.7343 32.7547 32.775 32.7954 32.8158 32.8361 32.8565 32.8769 32.8972 32.9176 32.938 32.9584 32.9787 32.9991 33.0195 33.0398 33.0602 33.0806 33.1009 33.1213 33.1417 33.1621 33.1824 33.2028 33.2232 33.2435 33.2639 33.2843 33.3046 33.325 33.3454 33.3658 33.3861 33.4065 33.4269 33.4472 33.4676 33.488 33.5083 33.5287 33.5491 33.5694 33.5898 33.6102 33.6306 33.6509 33.6713 33.6917 33.712 33.7324 33.7528 33.7731 33.7935 33.8139 33.8343 33.8546 33.875 33.8954 33.9157 33.9361 33.9565 33.9768 33.9972 34.0176 34.038 34.0583 34.0787 34.0991 34.1194 34.1398 34.1602 34.1805 34.2009 34.2213 34.2417 34.262 34.2824 34.3028 34.3231 34.3435 34.3639 34.3842 34.4046 34.425 34.4454 34.4657 34.4861 34.5065 34.5268 34.5472 34.5676 34.5879 34.6083 34.6287 34.649 34.6694 34.6898 34.7102 34.7305 34.7509 34.7713 34.7916 34.812 34.8324 34.8527 34.8731 34.8935 34.9139 34.9342 34.9546 34.975 34.9953 35.0157 35.0361 35.0564 35.0768 35.0972 35.1176 35.1379 35.1583 35.1787 35.199 35.2194 35.2398 35.2601 35.2805 35.3009 35.3213 35.3416 35.362 35.3824 35.4027 35.4231 35.4435 35.4638 35.4842 35.5046 35.525 35.5453 35.5657 35.5861 35.6064 35.6268 35.6472 35.6675 35.6879 35.7083 35.7286 35.749 35.7694 35.7898 35.8101 35.8305 35.8509 35.8712 35.8916 35.912 35.9323 35.9527 35.9731 35.9935 36.0138 36.0342 36.0546 36.0749 36.0953 36.1157 36.136 36.1564 36.1768 36.1972 36.2175 36.2379 36.2583 36.2786 36.299 36.3194 36.3397 36.3601 36.3805 36.4009 36.4212 36.4416 36.462 36.4823 36.5027 36.5231 36.5434 36.5638 36.5842 36.6046 36.6249 36.6453 36.6657 36.686 36.7064 36.7268 36.7471 36.7675 36.7879 36.8082 36.8286 36.849 36.8694 36.8897 36.9101 36.9305 36.9508 36.9712 36.9916 37.0119 37.0323 37.0527 37.0731 37.0934 37.1138 37.1342 37.1545 37.1749 37.1953 37.2156 37.236 37.2564 37.2768 37.2971 37.3175 37.3379 37.3582 37.3786 37.399 37.4193 37.4397 37.4601 37.4805 37.5008 37.5212 37.5416 37.5619 37.5823 37.6027 37.623 37.6434 37.6638 37.6842 37.7045 37.7249 37.7453 37.7656 37.786 37.8064 37.8267 37.8471 37.8675 37.8878 37.9082 37.9286 37.949 37.9693 37.9897 38.0101 38.0304 38.0508 38.0712 38.0915 38.1119 38.1323 38.1527 38.173 38.1934 38.2138 38.2341 38.2545 38.2749 38.2952 38.3156 38.336 38.3564 38.3767 38.3971 38.4175 38.4378 38.4582 38.4786 38.4989 38.5193 38.5397 38.5601 38.5804 38.6008 38.6212 38.6415 38.6619 38.6823 38.7026 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69.6444 69.6648 69.6851 69.7055 69.7259 69.7462 69.7666 69.787 69.8073 69.8277 69.8481 69.8685 69.8888 69.9092 69.9296 69.9499 69.9703 69.9907 70.011 70.0314 70.0518 70.0721 70.0925 70.1129 70.1333 70.1536 70.174 70.1944 70.2147 70.2351 70.2555 70.2758 70.2962 70.3166 70.337 70.3573 70.3777 70.3981 70.4184 70.4388 70.4592 70.4795 70.4999 70.5203 70.5407 70.561 70.5814 70.6018 70.6221 70.6425 70.6629 70.6832 70.7036 70.724 70.7444 70.7647 70.7851 70.8055 70.8258 70.8462 70.8666 70.8869 70.9073 70.9277 70.9481 70.9684 70.9888 71.0092 71.0295 71.0499 71.0703 71.0906 71.111 71.1314 71.1517 71.1721 71.1925 71.2129 71.2332 71.2536 71.274 71.2943 71.3147 71.3351 71.3554 71.3758 71.3962 71.4166 71.4369 71.4573 71.4777 71.498 71.5184 71.5388 71.5591 71.5795 71.5999 71.6203 71.6406 71.661 71.6814 71.7017 71.7221 71.7425 71.7628 71.7832 71.8036 71.824 71.8443 71.8647 71.8851 71.9054 71.9258 71.9462 71.9665 71.9869 72.0073 72.0277 72.048 72.0684 72.0888 72.1091 72.1295 72.1499 72.1702 72.1906 72.211 72.2313 72.2517 72.2721 72.2925 72.3128 72.3332 72.3536 72.3739 72.3943 72.4147 72.435 72.4554 72.4758 72.4962 72.5165 72.5369 72.5573 72.5776 72.598 72.6184 72.6387 72.6591 72.6795 72.6999 72.7202 72.7406 72.761 72.7813 72.8017 72.8221 72.8424 72.8628 72.8832 72.9036 72.9239 72.9443 72.9647 72.985 73.0054 73.0258 73.0461 73.0665 73.0869 73.1073 73.1276 73.148 73.1684 73.1887 73.2091 73.2295 73.2498 73.2702 73.2906 73.3109 73.3313 73.3517 73.3721 73.3924 73.4128 73.4332 73.4535 73.4739 73.4943 73.5146 73.535 73.5554 73.5758 73.5961 73.6165 73.6369 73.6572 73.6776 73.698 73.7183 73.7387 73.7591 73.7795 73.7998 73.8202 73.8406 73.8609 73.8813 73.9017 73.922 73.9424 73.9628 73.9832 74.0035 74.0239 74.0443 74.0646 74.085 74.1054 74.1257 74.1461 74.1665 74.1869 74.2072 74.2276 74.248 74.2683 74.2887 74.3091 74.3294 74.3498 74.3702 74.3905 74.4109 74.4313 74.4517 74.472 74.4924 74.5128 74.5331 74.5535 74.5739 74.5942 74.6146 74.635 74.6554 74.6757 74.6961 74.7165 74.7368 74.7572 74.7776 74.7979 74.8183 74.8387 74.8591 74.8794 74.8998 74.9202 74.9405 74.9609 74.9813 75.0016 75.022 75.0424 75.0628 75.0831 75.1035 75.1239 75.1442 75.1646 75.185 75.2053 75.2257 75.2461 75.2665 75.2868 75.3072 75.3276 75.3479 75.3683 75.3887 75.409 75.4294 75.4498 75.4701 75.4905 75.5109 75.5313 75.5516 75.572 75.5924 75.6127 75.6331 75.6535 75.6738 75.6942 75.7146 75.735 75.7553 75.7757 75.7961 75.8164 75.8368 75.8572 75.8775 75.8979 75.9183 75.9387 75.959 75.9794 75.9998 76.0201 76.0405 76.0609 76.0812 76.1016 76.122 76.1424 76.1627 76.1831 76.2035 76.2238 76.2442 76.2646 76.2849 76.3053 76.3257 76.3461 76.3664 76.3868 76.4072 76.4275 76.4479 76.4683 76.4886 76.509 76.5294 76.5497 76.5701 76.5905 76.6109 76.6312 76.6516 76.672 76.6923 76.7127 76.7331 76.7534 76.7738 76.7942 76.8146 76.8349 76.8553 76.8757 76.896 76.9164 76.9368 76.9571 76.9775 76.9979 77.0183 77.0386 77.059 77.0794 77.0997 77.1201 77.1405 77.1608 77.1812 77.2016 77.222 77.2423 77.2627 77.2831 77.3034 77.3238 77.3442 77.3645 77.3849 77.4053 77.4257 77.446 77.4664 77.4868 77.5071 77.5275 77.5479 77.5682 77.5886 77.609 77.6293 77.6497 77.6701 77.6905 77.7108 77.7312 77.7516 77.7719 77.7923 77.8127 77.833 77.8534 77.8738 77.8942 77.9145 77.9349 77.9553 77.9756 77.996 78.0164 78.0367 78.0571 78.0775 78.0979 78.1182 78.1386 78.159 78.1793 78.1997 78.2201 78.2404 78.2608 78.2812 78.3016 78.3219 78.3423 78.3627 78.383 78.4034 78.4238 78.4441 78.4645 78.4849 78.5053 78.5256 78.546 78.5664 78.5867 78.6071 78.6275 78.6478 78.6682 78.6886 78.7089 78.7293 78.7497 78.7701 78.7904 78.8108 78.8312 78.8515 78.8719 78.8923 78.9126 78.933 78.9534 78.9738 78.9941 79.0145 79.0349 79.0552 79.0756 79.096 79.1163 79.1367 79.1571 79.1775 79.1978 79.2182 79.2386 79.2589 79.2793 79.2997 79.32 79.3404 79.3608 79.3812 79.4015 79.4219 79.4423 79.4626 79.483 79.5034 79.5237 79.5441 79.5645 79.5849 79.6052 79.6256 79.646 79.6663 79.6867 79.7071 79.7274 79.7478 79.7682 79.7885 79.8089 79.8293 79.8497 79.87 79.8904 79.9108 79.9311 79.9515 79.9719 79.9922 80.0126 80.033 80.0534 80.0737 80.0941 80.1145 80.1348 80.1552 80.1756 80.1959 80.2163 80.2367 80.2571 80.2774 80.2978 80.3182 80.3385 80.3589 80.3793 80.3996 80.42 80.4404 80.4608 80.4811 80.5015 80.5219 80.5422 80.5626 80.583 80.6033 80.6237 80.6441 80.6645 80.6848 80.7052 80.7256 80.7459 80.7663 80.7867 80.807 80.8274 80.8478 80.8681 80.8885 80.9089 80.9293 80.9496 80.97 80.9904 81.0107 81.0311 81.0515 81.0718 81.0922 81.1126 81.133 81.1533 81.1737 81.1941 81.2144 81.2348 81.2552 81.2755 81.2959 81.3163 81.3367 81.357 81.3774 81.3978 81.4181 81.4385 81.4589 81.4792 81.4996 81.52 81.5404 81.5607 81.5811 81.6015 81.6218 81.6422 81.6626 81.6829 81.7033 81.7237 81.7441 81.7644 81.7848 81.8052 81.8255 81.8459 81.8663 81.8866 81.907 81.9274 81.9477 81.9681 81.9885 82.0089 82.0292 82.0496 82.07 82.0903 82.1107 82.1311 82.1514 82.1718 82.1922 82.2126 82.2329 82.2533 82.2737 82.294 82.3144 82.3348 82.3551 82.3755 82.3959 82.4163 82.4366 82.457 82.4774 82.4977 82.5181 82.5385 82.5588 82.5792 82.5996 82.62 82.6403 82.6607 82.6811 82.7014 82.7218 82.7422 82.7625 82.7829 82.8033 82.8237 82.844 82.8644 82.8848 82.9051 82.9255 82.9459 82.9662 82.9866 83.007 83.0273 83.0477 83.0681 83.0885 83.1088 83.1292 83.1496 83.1699 83.1903 83.2107 83.231 83.2514 83.2718 83.2922 83.3125 83.3329 83.3533 83.3736 83.394 83.4144 83.4347 83.4551 83.4755 83.4959 83.5162 83.5366 83.557 83.5773 83.5977 83.6181 83.6384 83.6588 83.6792 83.6996 83.7199 83.7403 83.7607 83.781 83.8014 83.8218 83.8421 83.8625 83.8829 83.9033 83.9236 83.944 83.9644 83.9847 84.0051 84.0255 84.0458 84.0662 84.0866 84.1069 84.1273 84.1477 84.1681 84.1884 84.2088 84.2292 84.2495 84.2699 84.2903 84.3106 84.331 84.3514 84.3718 84.3921 84.4125 84.4329 84.4532 84.4736 84.494 84.5143 84.5347 84.5551 84.5755 84.5958 84.6162 84.6366 84.6569 84.6773 84.6977 84.718 84.7384 84.7588 84.7792 84.7995 84.8199 84.8403 84.8606 84.881 84.9014 84.9217 84.9421 84.9625 84.9829 85.0032 85.0236 85.044 85.0643 85.0847 85.1051 85.1254 85.1458 85.1662 85.1865 85.2069 85.2273 85.2477 85.268 85.2884 85.3088 85.3291 85.3495 85.3699 85.3902 85.4106 85.431 85.4514 85.4717 85.4921 85.5125 85.5328 85.5532 85.5736 85.5939 85.6143 85.6347 85.6551 85.6754 85.6958 85.7162 85.7365 85.7569 85.7773 85.7976 85.818 85.8384 85.8588 85.8791 85.8995 85.9199 85.9402 85.9606 85.981 86.0013 86.0217 86.0421 86.0625 86.0828 86.1032 86.1236 86.1439 86.1643 86.1847 86.205 86.2254 86.2458 86.2661 86.2865 86.3069 86.3273 86.3476 86.368 86.3884 86.4087 86.4291 86.4495 86.4698 86.4902 86.5106 86.531 86.5513 86.5717 86.5921 86.6124 86.6328 86.6532 86.6735 86.6939 86.7143 86.7347 86.755 86.7754 86.7958 86.8161 86.8365 86.8569 86.8772 86.8976 86.918 86.9384 86.9587 86.9791 86.9995 87.0198 87.0402 87.0606 87.0809 87.1013 87.1217 87.1421 87.1624 87.1828 87.2032 87.2235 87.2439 87.2643 87.2846 87.305 87.3254 87.3457 87.3661 87.3865 87.4069 87.4272 87.4476 87.468 87.4883 87.5087 87.5291 87.5494 87.5698 87.5902 87.6106 87.6309 87.6513 87.6717 87.692 87.7124 87.7328 87.7531 87.7735 87.7939 87.8143 87.8346 87.855 87.8754 87.8957 87.9161 87.9365 87.9568 87.9772 87.9976 88.018 88.0383 88.0587 88.0791 88.0994 88.1198 88.1402 88.1605 88.1809 88.2013 88.2217 88.242 88.2624 88.2828 88.3031 88.3235 88.3439 88.3642 88.3846 88.405 88.4253 88.4457 88.4661 88.4865 88.5068 88.5272 88.5476 88.5679 88.5883 88.6087 88.629 88.6494 88.6698 88.6902 88.7105 88.7309 88.7513 88.7716 88.792 88.8124 88.8327 88.8531 88.8735 88.8939 88.9142 88.9346 88.955 88.9753 88.9957 89.0161 89.0364 89.0568 89.0772 89.0976 89.1179 89.1383 89.1587 89.179 89.1994 89.2198 89.2401 89.2605 89.2809 89.3013 89.3216 89.342 89.3624 89.3827 89.4031 89.4235 89.4438 89.4642 89.4846 89.5049 89.5253 89.5457 89.5661 89.5864 89.6068 89.6272 89.6475 89.6679 89.6883 89.7086 89.729 89.7494 89.7698 89.7901 89.8105 89.8309 89.8512 89.8716 89.892 89.9123 89.9327 89.9531 89.9735 89.9938 90.0142 90.0346 90.0549 90.0753 90.0957 90.116 90.1364 90.1568 90.1772 90.1975 90.2179 90.2383 90.2586 90.279 90.2994 90.3197 90.3401 90.3605 90.3809 90.4012 90.4216 90.442 90.4623 90.4827 90.5031 90.5234 90.5438 90.5642 90.5845 90.6049 90.6253 90.6457 90.666 90.6864 90.7068 90.7271 90.7475 90.7679 90.7882 90.8086 90.829 90.8494 90.8697 90.8901 90.9105 90.9308 90.9512 90.9716 90.9919 91.0123 91.0327 91.0531 91.0734 91.0938 91.1142 91.1345 91.1549 91.1753 91.1956 91.216 91.2364 91.2568 91.2771 91.2975 91.3179 91.3382 91.3586 91.379 91.3993 91.4197 91.4401 91.4605 91.4808 91.5012 91.5216 91.5419 91.5623 91.5827 91.603 91.6234 91.6438 91.6641 91.6845 91.7049 91.7253 91.7456 91.766 91.7864 91.8067 91.8271 91.8475 91.8678 91.8882 91.9086 91.929 91.9493 91.9697 91.9901 92.0104 92.0308 92.0512 92.0715 92.0919 92.1123 92.1327 92.153 92.1734 92.1938 92.2141 92.2345 92.2549 92.2752 92.2956 92.316 92.3364 92.3567 92.3771 92.3975 92.4178 92.4382 92.4586 92.4789 92.4993 92.5197 92.5401 92.5604 92.5808 92.6012 92.6215 92.6419 92.6623 92.6826 92.703 92.7234 92.7437 92.7641 92.7845 92.8049 92.8252 92.8456 92.866 92.8863 92.9067 92.9271 92.9474 92.9678 92.9882 93.0086 93.0289 93.0493 93.0697 93.09 93.1104 93.1308 93.1511 93.1715 93.1919 93.2123 93.2326 93.253 93.2734 93.2937 93.3141 93.3345 93.3548 93.3752 93.3956 93.416 93.4363 93.4567 93.4771 93.4974 93.5178 93.5382 93.5585 93.5789 93.5993 93.6197 93.64 93.6604 93.6808 93.7011 93.7215 93.7419 93.7622 93.7826 93.803 93.8233 93.8437 93.8641 93.8845 93.9048 93.9252 93.9456 93.9659 93.9863 94.0067 94.027 94.0474 94.0678 94.0882 94.1085 94.1289 94.1493 94.1696 94.19 94.2104 94.2307 94.2511 94.2715 94.2919 94.3122 94.3326 94.353 94.3733 94.3937 94.4141 94.4344 94.4548 94.4752 94.4956 94.5159 94.5363 94.5567 94.577 94.5974 94.6178 94.6381 94.6585 94.6789 94.6993 94.7196 94.74 94.7604 94.7807 94.8011 94.8215 94.8418 94.8622 94.8826 94.9029 94.9233 94.9437 94.9641 94.9844 95.0048 95.0252 95.0455 95.0659 95.0863 95.1066 95.127 95.1474 95.1678 95.1881 95.2085 95.2289 95.2492 95.2696 95.29 95.3103 95.3307 95.3511 95.3715 95.3918 95.4122 95.4326 95.4529 95.4733 95.4937 95.514 95.5344 95.5548 95.5752 95.5955 95.6159 95.6363 95.6566 95.677 95.6974 95.7177 95.7381 95.7585 95.7789 95.7992 95.8196 95.84 95.8603 95.8807 95.9011 95.9214 95.9418 95.9622 95.9825 96.0029 96.0233 96.0437 96.064 96.0844 96.1048 96.1251 96.1455 96.1659 96.1862 96.2066 96.227 96.2474 96.2677 96.2881 96.3085 96.3288 96.3492 96.3696 96.3899 96.4103 96.4307 96.4511 96.4714 96.4918 96.5122 96.5325 96.5529 96.5733 96.5936 96.614 96.6344 96.6548 96.6751 96.6955 96.7159 96.7362 96.7566 96.777 96.7973 96.8177 96.8381 96.8585 96.8788 96.8992 96.9196 96.9399 96.9603 96.9807 97.001 97.0214 97.0418 97.0621 97.0825 97.1029 97.1233 97.1436 97.164 97.1844 97.2047 97.2251 97.2455 97.2658 97.2862 97.3066 97.327 97.3473 97.3677 97.3881 97.4084 97.4288 97.4492 97.4695 97.4899 97.5103 97.5307 97.551 97.5714 97.5918 97.6121 97.6325 97.6529 97.6732 97.6936 97.714 97.7344 97.7547 97.7751 97.7955 97.8158 97.8362 97.8566 97.8769 97.8973 97.9177 97.9381 97.9584 97.9788 97.9992 98.0195 98.0399 98.0603 98.0806 98.101 98.1214 98.1417 98.1621 98.1825 98.2029 98.2232 98.2436 98.264 98.2843 98.3047 98.3251 98.3454 98.3658 98.3862 98.4066 98.4269 98.4473 98.4677 98.488 98.5084 98.5288 98.5491 98.5695 98.5899 98.6103 98.6306 98.651 98.6714 98.6917 98.7121 98.7325 98.7528 98.7732 98.7936 98.814 98.8343 98.8547 98.8751 98.8954 98.9158 98.9362 98.9565 98.9769 98.9973 99.0177 99.038 99.0584 99.0788 99.0991 99.1195 99.1399 99.1602 99.1806 99.201 99.2213 99.2417 99.2621 99.2825 99.3028 99.3232 99.3436 99.3639 99.3843 99.4047 99.425 99.4454 99.4658 99.4862 99.5065 99.5269 99.5473 99.5676 99.588 99.6084 99.6287 99.6491 99.6695 99.6899 99.7102 99.7306 99.751 99.7713 99.7917 99.8121 99.8324 99.8528 99.8732 99.8936 99.9139 99.9343 99.9547 99.975 99.9954 100.016 100.036 100.057 100.077 100.097 100.118 100.138 100.158 100.179 100.199 100.219 100.24 100.26 100.281 100.301 100.321 100.342 100.362 100.382 100.403 100.423 100.444 100.464 100.484 100.505 100.525 100.545 100.566 100.586 100.606 100.627 100.647 100.668 100.688 100.708 100.729 100.749 100.769 100.79 100.81 100.831 100.851 100.871 100.892 100.912 100.932 100.953 100.973 100.994 101.014 101.034 101.055 101.075 101.095 101.116 101.136 101.156 101.177 101.197 101.218 101.238 101.258 101.279 101.299 101.319 101.34 101.36 101.381 101.401 101.421 101.442 101.462 101.482 101.503 101.523 101.544 101.564 101.584 101.605 101.625 101.645 101.666 101.686 101.706 101.727 101.747 101.768 101.788 101.808 101.829 101.849 # matrix of S(q,w) values (m rows x n columns, 100x5001), one line per q value: sqw 7.1304014e+00 2.7596409e+01 8.5247820e+00 5.0121337e+00 1.5927424e+00 4.1772431e-01 3.1938049e-01 2.1789824e-01 1.6557739e-01 1.3377730e-01 1.1195062e-01 8.8275645e-02 8.2098879e-02 7.1799002e-02 6.3563310e-02 5.6802038e-02 5.1109725e-02 4.6183054e-02 4.2078899e-02 3.8893626e-02 3.6288115e-02 3.3797924e-02 3.1265607e-02 2.7673814e-02 2.6645408e-02 2.4954563e-02 2.3677609e-02 2.2577060e-02 2.0930449e-02 2.0390179e-02 1.9388627e-02 1.8538728e-02 1.7784140e-02 1.6989534e-02 1.6123312e-02 1.5315013e-02 1.4700496e-02 1.4274495e-02 1.3910628e-02 1.3496738e-02 1.3029136e-02 1.2561534e-02 1.2116575e-02 1.1685833e-02 1.1277209e-02 1.0916502e-02 1.0617405e-02 1.0249327e-02 1.0128740e-02 9.8712435e-03 9.6058480e-03 9.3599357e-03 9.0108142e-03 8.8860151e-03 8.6237790e-03 8.3520640e-03 8.0703446e-03 7.6554009e-03 7.5353406e-03 7.3341878e-03 7.1662093e-03 6.9945443e-03 6.6864957e-03 6.5732812e-03 6.3558046e-03 6.1725550e-03 6.0245866e-03 5.9013672e-03 5.7949982e-03 5.6870496e-03 5.5638302e-03 5.4379779e-03 5.3284496e-03 5.2330333e-03 5.1310880e-03 5.0034978e-03 4.8542654e-03 4.7024526e-03 4.5613822e-03 4.4336345e-03 4.3188928e-03 4.2242666e-03 4.1607085e-03 4.1201619e-03 4.0714009e-03 3.9905710e-03 3.8828859e-03 3.7634577e-03 3.6429766e-03 3.5378716e-03 3.4594639e-03 3.3940100e-03 3.3199731e-03 3.2306655e-03 3.1366184e-03 3.0328298e-03 3.0129251e-03 2.9825416e-03 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