From ac561095b12ac7636bcc569600fedefbaf9710e2 Mon Sep 17 00:00:00 2001 From: exapde Date: Tue, 21 May 2024 21:51:26 -0400 Subject: [PATCH] Change int* to tagint* --- examples/PACKAGES/pod/Ta/Ta_compute.pod | 21 +++++++--- examples/PACKAGES/pod/Ta/dump_dd | 25 ++++++++++++ examples/PACKAGES/pod/Ta/dump_ld | 25 ++++++++++++ examples/PACKAGES/pod/Ta/pod.gdd.dat | 50 ++++++++++++++++++++++++ examples/PACKAGES/pod/Ta/pod.ldd.dat | 52 ++++++++++++++++++++++++- examples/PACKAGES/pod/Ta/sample_ld.txt | 2 + src/ML-POD/compute_pod_atom.cpp | 3 +- src/ML-POD/compute_pod_atom.h | 2 +- src/ML-POD/compute_pod_global.cpp | 2 +- src/ML-POD/compute_pod_global.h | 2 +- src/ML-POD/compute_pod_local.cpp | 2 +- src/ML-POD/compute_pod_local.h | 2 +- src/ML-POD/compute_podd_atom.cpp | 2 +- src/ML-POD/compute_podd_atom.h | 2 +- 14 files changed, 177 insertions(+), 15 deletions(-) create mode 100644 examples/PACKAGES/pod/Ta/dump_dd create mode 100644 examples/PACKAGES/pod/Ta/dump_ld create mode 100644 examples/PACKAGES/pod/Ta/sample_ld.txt diff --git a/examples/PACKAGES/pod/Ta/Ta_compute.pod b/examples/PACKAGES/pod/Ta/Ta_compute.pod index 4886c846a5..d0b574991b 100644 --- a/examples/PACKAGES/pod/Ta/Ta_compute.pod +++ b/examples/PACKAGES/pod/Ta/Ta_compute.pod @@ -3,7 +3,7 @@ # initialize simulation variable nsteps index 0 -variable nrep equal 1 +variable nrep equal 2 variable a equal 2.0 units metal @@ -30,12 +30,23 @@ variable rcutfac equal 6.0 pair_style zero ${rcutfac} pair_coeff * * -# calculate global POD descriptors and their derivatives -compute gdd all pod/gdd Ta_param.pod "" "" C C +# set up per-atom computes + +compute ld all pod/atom Ta_param.pod Ta_projection_matrix.pod Ta_centroids.pod Ta Ta +compute dd all podd/atom Ta_param.pod Ta_projection_matrix.pod Ta_centroids.pod Ta Ta + +# set up compute snap generating global array + +compute gdd all pod/gdd Ta_param.pod Ta_projection_matrix.pod Ta_centroids.pod Ta Ta fix gdd all ave/time 1 1 1 c_gdd[*] file pod.gdd.dat mode vector -# calculate per-atom POD descriptors and their derivatives -compute ldd all pod/ldd Ta_param.pod "" "" C C +compute ldd all pod/ldd Ta_param.pod Ta_projection_matrix.pod Ta_centroids.pod Ta Ta fix ldd all ave/time 1 1 1 c_ldd[*] file pod.ldd.dat mode vector +dump mydump_ld all custom 1000 dump_ld id c_ld[*] +dump mydump_dd all custom 1000 dump_dd id c_dd[*] +variable sample_ld1 equal C_ld[1][10] # Arbitrary local descriptor +fix ldprint all print 1 "${sample_ld1}" file sample_ld.txt + +run ${nsteps} diff --git a/examples/PACKAGES/pod/Ta/dump_dd b/examples/PACKAGES/pod/Ta/dump_dd new file mode 100644 index 0000000000..a0b3e47342 --- /dev/null +++ b/examples/PACKAGES/pod/Ta/dump_dd @@ -0,0 +1,25 @@ +ITEM: TIMESTEP +0 +ITEM: NUMBER OF ATOMS +16 +ITEM: BOX BOUNDS pp pp pp +0.0000000000000000e+00 4.0000000000000000e+00 +0.0000000000000000e+00 4.0000000000000000e+00 +0.0000000000000000e+00 4.0000000000000000e+00 +ITEM: ATOMS id c_dd[1] c_dd[2] c_dd[3] c_dd[4] c_dd[5] c_dd[6] c_dd[7] 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b/examples/PACKAGES/pod/Ta/dump_ld new file mode 100644 index 0000000000..38ef4d6446 --- /dev/null +++ b/examples/PACKAGES/pod/Ta/dump_ld @@ -0,0 +1,25 @@ +ITEM: TIMESTEP +0 +ITEM: NUMBER OF ATOMS +16 +ITEM: BOX BOUNDS pp pp pp +0.0000000000000000e+00 4.0000000000000000e+00 +0.0000000000000000e+00 4.0000000000000000e+00 +0.0000000000000000e+00 4.0000000000000000e+00 +ITEM: ATOMS id c_ld[1] c_ld[2] c_ld[3] c_ld[4] c_ld[5] c_ld[6] c_ld[7] c_ld[8] c_ld[9] c_ld[10] c_ld[11] c_ld[12] c_ld[13] c_ld[14] c_ld[15] c_ld[16] c_ld[17] c_ld[18] c_ld[19] c_ld[20] c_ld[21] c_ld[22] c_ld[23] c_ld[24] c_ld[25] c_ld[26] c_ld[27] c_ld[28] c_ld[29] c_ld[30] c_ld[31] c_ld[32] c_ld[33] c_ld[34] c_ld[35] c_ld[36] c_ld[37] c_ld[38] c_ld[39] c_ld[40] c_ld[41] c_ld[42] c_ld[43] c_ld[44] c_ld[45] c_ld[46] c_ld[47] c_ld[48] c_ld[49] c_ld[50] c_ld[51] c_ld[52] c_ld[53] c_ld[54] c_ld[55] c_ld[56] c_ld[57] c_ld[58] c_ld[59] c_ld[60] c_ld[61] c_ld[62] c_ld[63] c_ld[64] c_ld[65] c_ld[66] c_ld[67] c_ld[68] c_ld[69] c_ld[70] c_ld[71] c_ld[72] c_ld[73] c_ld[74] c_ld[75] c_ld[76] c_ld[77] c_ld[78] c_ld[79] c_ld[80] c_ld[81] c_ld[82] c_ld[83] c_ld[84] c_ld[85] c_ld[86] c_ld[87] c_ld[88] c_ld[89] c_ld[90] c_ld[91] c_ld[92] c_ld[93] c_ld[94] c_ld[95] c_ld[96] c_ld[97] c_ld[98] c_ld[99] c_ld[100] c_ld[101] c_ld[102] c_ld[103] c_ld[104] c_ld[105] c_ld[106] c_ld[107] c_ld[108] c_ld[109] c_ld[110] c_ld[111] c_ld[112] c_ld[113] c_ld[114] c_ld[115] c_ld[116] c_ld[117] c_ld[118] c_ld[119] c_ld[120] c_ld[121] c_ld[122] +1 4.49503 10.9496 -9.51513 9.76683 -18.2757 5.06405 39.8529 0.114405 13.3216 0.134392 8.07812 236.479 0.110188 78.9295 0.193969 47.5315 178.577 1.65132 59.8012 1.7958 36.4171 188.149 1.6524 63.4702 2.14313 38.4147 658.786 0.886907 220.671 1.19001 132.84 353.335 1.01431 118.109 0.341942 1.19152 0.342292 39.5941 5107.23 2.37973 1704.64 0.821219 4.18914 0.816552 569.718 -3351.46 -30.9914 -1122.33 -10.8333 -33.7029 -10.4267 -377.565 3624.52 31.8319 1222.7 10.4135 41.2855 10.8783 417.427 3132.67 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-24.8624 -7.88383 -400.804 3543.39 61.6623 1193.82 21.9927 44.9589 21.3929 406.677 3357.44 18557.6 4.44736 10.4559 -9.35877 9.42591 -16.8457 5.10814 40.1193 0.115003 13.4852 0.184936 8.18134 221.752 0.175535 73.9663 0.208962 44.4583 177.659 1.19453 60.019 1.27357 37.3641 180.217 3.13614 60.7175 2.28661 37.353 575.61 0.0776223 192.025 0.876451 115.362 361.913 1.03743 121.649 0.343655 1.66829 0.359161 41.2376 4703.01 3.72281 1568.71 1.26718 4.43174 1.26516 523.591 -3372.51 -22.6758 -1139.35 -7.66154 -24.1764 -7.66629 -389.744 3445.62 59.9608 1160.88 21.3859 43.7183 20.8026 395.455 3264.79 18045.5 +15 4.45001 10.6647 -10.3214 10.4179 -16.5376 4.96853 39.0457 0.209616 13.0697 0.314628 7.92922 224.259 0.00122903 74.9852 0.212134 45.0974 210.051 1.60376 70.198 1.64888 42.7542 213.999 3.54524 72.3963 2.94257 44.8223 539.256 0.533153 182.151 1.35647 110.275 342.598 1.83923 114.678 0.630492 2.76064 0.643968 38.5493 4715.73 0.0258441 1576.8 0.0084369 4.46077 0.0100225 528.842 -4274.75 -32.6382 -1428.6 -11.3958 -33.5564 -10.9202 -478.701 4395.84 72.8243 1487.12 28.0366 60.4446 26.4561 510.631 3006.06 17265.3 4.32428 10.3634 -10.0297 10.1235 -16.0703 4.82814 37.9424 0.203693 12.7005 0.305738 7.70517 217.922 0.0011943 72.8664 0.20614 43.8232 204.115 1.55844 68.2145 1.60229 41.5462 207.952 3.44506 70.3507 2.85942 43.5558 524.018 0.518088 177.004 1.31814 107.159 332.918 1.78727 111.437 0.612677 2.68263 0.625772 37.46 4582.49 0.0251139 1532.24 0.0081985 4.33473 0.00973933 513.899 -4153.97 -31.7159 -1388.24 -11.0738 -32.6082 -10.6116 -465.175 4271.63 70.7665 1445.1 27.2444 58.7367 25.7086 496.203 2921.12 16777.4 +16 4.27948 10.95 -10.7222 8.68245 -18.3091 6.44809 36.1316 0.0234372 12.0796 0.0652203 7.31654 236.554 0.0649123 78.9837 0.147443 47.5933 226.817 0.704649 75.7309 1.21605 45.8433 148.727 1.44989 49.9423 1.41678 30.2789 661.359 0.386736 220.952 0.914192 133.334 305.059 0.19788 101.988 0.0672921 0.550654 0.0702479 34.198 5110.31 1.40231 1706.3 0.470246 3.18524 0.483568 570.692 -4798.07 -14.9061 -1602.01 -5.03752 -25.7242 -4.89161 -535.779 2547.64 24.836 855.492 8.69962 24.2689 8.10366 289.245 2575.61 16862.5 4.16351 10.6532 -10.4317 8.44716 -17.8129 6.27335 35.1525 0.0228021 11.7522 0.0634529 7.11827 230.143 0.0631532 76.8433 0.143448 46.3036 220.671 0.685554 73.6787 1.18309 44.601 144.697 1.4106 48.5889 1.37839 29.4584 643.437 0.376256 214.965 0.889419 129.721 296.792 0.192517 99.224 0.0654686 0.535732 0.0683443 33.2713 4971.82 1.36431 1660.06 0.457503 3.09892 0.470464 555.227 -4668.05 -14.5021 -1558.59 -4.90101 -25.0271 -4.75906 -521.26 2478.6 24.163 832.309 8.46387 23.6112 7.88406 281.407 2505.81 16405.5 diff --git a/examples/PACKAGES/pod/Ta/pod.gdd.dat b/examples/PACKAGES/pod/Ta/pod.gdd.dat index 90e8d11e27..4b9223da3a 100644 --- a/examples/PACKAGES/pod/Ta/pod.gdd.dat +++ b/examples/PACKAGES/pod/Ta/pod.gdd.dat @@ -1,3 +1,53 @@ # Time-averaged data for fix gdd # TimeStep Number-of-rows # Row c_gdd[1] c_gdd[2] c_gdd[3] c_gdd[4] c_gdd[5] c_gdd[6] c_gdd[7] c_gdd[8] c_gdd[9] c_gdd[10] c_gdd[11] c_gdd[12] c_gdd[13] c_gdd[14] c_gdd[15] c_gdd[16] c_gdd[17] c_gdd[18] c_gdd[19] c_gdd[20] c_gdd[21] c_gdd[22] c_gdd[23] c_gdd[24] c_gdd[25] c_gdd[26] c_gdd[27] c_gdd[28] c_gdd[29] c_gdd[30] c_gdd[31] c_gdd[32] c_gdd[33] c_gdd[34] c_gdd[35] c_gdd[36] c_gdd[37] c_gdd[38] c_gdd[39] c_gdd[40] c_gdd[41] c_gdd[42] c_gdd[43] c_gdd[44] c_gdd[45] c_gdd[46] c_gdd[47] c_gdd[48] c_gdd[49] c_gdd[50] c_gdd[51] c_gdd[52] c_gdd[53] c_gdd[54] c_gdd[55] c_gdd[56] c_gdd[57] c_gdd[58] c_gdd[59] c_gdd[60] c_gdd[61] c_gdd[62] c_gdd[63] c_gdd[64] c_gdd[65] c_gdd[66] c_gdd[67] c_gdd[68] c_gdd[69] c_gdd[70] c_gdd[71] c_gdd[72] c_gdd[73] c_gdd[74] c_gdd[75] c_gdd[76] c_gdd[77] c_gdd[78] c_gdd[79] c_gdd[80] c_gdd[81] c_gdd[82] c_gdd[83] c_gdd[84] c_gdd[85] c_gdd[86] c_gdd[87] c_gdd[88] c_gdd[89] c_gdd[90] c_gdd[91] c_gdd[92] c_gdd[93] c_gdd[94] c_gdd[95] c_gdd[96] c_gdd[97] c_gdd[98] c_gdd[99] c_gdd[100] c_gdd[101] c_gdd[102] c_gdd[103] c_gdd[104] c_gdd[105] c_gdd[106] c_gdd[107] c_gdd[108] c_gdd[109] c_gdd[110] c_gdd[111] c_gdd[112] c_gdd[113] c_gdd[114] c_gdd[115] c_gdd[116] c_gdd[117] c_gdd[118] c_gdd[119] c_gdd[120] c_gdd[121] c_gdd[122] c_gdd[123] +0 49 +1 16 70.7277 173.124 -163.439 152.639 -283.013 90.2585 617.106 1.79668 206.729 2.75743 125.362 3695.41 1.65196 1233.77 3.62193 742.305 3306.37 21.626 1107.51 22.1754 675.165 2877.11 47.8854 967.859 40.2821 590.662 9886.1 19.7751 3307.56 23.2977 1993.84 5388.08 15.8516 1805.04 5.45334 24.1971 5.58303 607.723 78894.8 35.0395 26340 11.6985 77.2638 11.7357 8807.88 -67155.2 -430.17 -22492.8 -144.816 -445.508 -142.368 -7569.1 54324.3 912.697 18277.4 329.673 766.397 320.538 6207.78 47076.9 281067 68.7747 168.344 -158.925 148.422 -275.2 87.7664 600.065 1.74692 201.021 2.68107 121.901 3593.39 1.60624 1199.71 3.52188 721.812 3215.04 21.0285 1076.92 21.5622 656.515 2797.6 46.558 941.114 39.1665 574.338 9613.26 19.231 3216.28 22.6552 1938.81 5239.29 15.4127 1755.19 5.30229 23.527 5.42837 590.941 76716.9 34.0698 25612.9 11.3748 75.1298 11.411 8564.74 -65299.9 -418.28 -21871.4 -140.813 -433.187 -138.434 -7359.98 52822.6 887.39 17772.2 320.528 745.166 311.647 6036.16 45777 273307 +2 0 -0.868675 0.599888 -2.90105 -7.20136 -5.12272 5.27625 -16.3404 -1.59346 -6.43223 -0.766075 -4.41914 26.1896 -1.13751 5.60943 -1.19171 1.00516 81.7413 -10.8687 22.9687 -5.50146 12.76 -276.161 22.9666 -99.6452 7.91947 -64.0875 361.737 -16.9919 114.925 -14.1191 61.5962 -229.445 -14.6731 -85.2317 -4.9257 -7.43373 -4.98612 -34.319 856.495 -24.1774 219.062 -8.53902 -24.9057 -8.72887 28.5786 -1439.01 174.012 -399.418 59.4653 87.3704 59.6 -82.3658 -7945.32 407.18 -2801.12 131.966 119.963 127.452 -1039.47 -2851.85 -5572.26 -0.843588 0.586556 -2.82063 -7.0012 -4.98837 5.13003 -15.8786 -1.54988 -6.25118 -0.745365 -4.29507 25.553 -1.10616 5.48333 -1.15901 0.994914 79.4244 -10.5712 22.3144 -5.35036 12.3964 -268.526 22.3266 -96.8919 7.69866 -62.3195 352.109 -16.5278 111.873 -13.7317 59.9688 -223.008 -14.2717 -82.8454 -4.79107 -7.23229 -4.84981 -33.361 835.065 -23.511 213.751 -8.30341 -24.2222 -8.48811 28.0344 -1396.96 169.264 -387.615 57.8383 84.9814 57.9713 -79.8311 -7726.07 395.814 -2723.84 128.268 116.602 123.886 -1010.8 -2772.14 -5410.84 +3 0 -0.664129 1.83247 -0.325192 -9.0165 -10.5228 5.55303 -11.3596 -0.677332 -3.7628 -1.6063 -2.11452 79.9996 0.811548 26.8793 -0.66575 16.5484 23.2835 -13.8895 6.96322 -15.0333 3.78103 -340.439 -32.7659 -112.626 -20.26 -68.9943 748.727 -3.37269 245.719 -3.17252 148.373 -147.213 -6.10653 -48.9283 -2.00903 -14.4319 -2.24214 -16.1049 2596.04 17.7173 870.44 5.78559 -13.3798 5.82253 293.464 -998.841 278.532 -317.895 95.1586 297.41 88.0867 -93.3039 -9665.09 -651.785 -3212.81 -210.529 -417.203 -219.21 -1063 -1700.24 1121.99 -0.606046 1.87956 -0.405045 -8.6814 -10.3944 5.44804 -10.6982 -0.657664 -3.54244 -1.5607 -1.98554 79.8911 0.790163 26.8384 -0.645584 16.5138 24.3834 -13.4933 7.3551 -14.605 4.03241 -329.403 -31.8423 -108.967 -19.6813 -66.7557 733.847 -3.27669 240.872 -3.07779 145.443 -140.103 -5.92942 -46.5577 -1.95063 -14.0225 -2.1773 -15.3173 2569.53 17.2501 861.487 5.63337 -12.9721 5.66919 290.405 -1005.57 270.594 -320.619 92.4467 288.942 85.5725 -94.6044 -9367.1 -633.427 -3113.65 -204.592 -405.315 -213.034 -1030.11 -1626.62 1251.82 +4 0 0.62461 -1.06131 1.26358 7.81385 5.80491 -5.5232 11.0579 0.754943 4.31978 0.514041 3.07059 -46.3021 -0.832423 -14.7072 0.216807 -7.4849 -53.1451 6.44185 -11.223 4.20056 -5.58781 302.456 1.46723 105.286 8.99502 68.2125 -406.882 14.4242 -127.106 9.87564 -72.229 147.69 6.71087 54.9478 2.48175 4.79226 2.38854 22.1169 -1500.78 -17.9293 -485.091 -6.04633 4.12078 -6.03139 -151.614 1673.42 -128.281 429.407 -37.2636 -73.5569 -40.2964 57.9052 8781.77 76.1352 3023.68 19.515 214.895 25.7603 1071.83 1754.97 1231.2 0.582567 -1.09156 1.2816 7.54292 5.74366 -5.39858 10.5321 0.733079 4.12654 0.4989 2.94091 -46.2965 -0.810299 -14.726 0.209842 -7.53392 -52.6828 6.25209 -11.2515 4.07394 -5.64015 293.016 1.40954 102.013 8.73038 66.1069 -399.171 14.0221 -124.776 9.59642 -70.9451 141.652 6.51661 52.7731 2.41004 4.65157 2.31944 21.2844 -1486.55 -17.4525 -480.781 -5.88568 3.98613 -5.87099 -150.464 1646.32 -124.505 423.983 -36.1578 -71.3189 -39.1079 58.4937 8517.88 73.6918 2932.99 18.8592 208.639 24.9299 1039.79 1689.09 1096.38 +5 0 -1.01951 3.33876 3.18949 -5.38157 -14.026 -0.325905 -18.3736 -1.23197 -7.24667 -1.78442 -5.31593 141.047 -1.42041 45.2052 -0.816533 25.8762 -136.679 3.85383 -45.0719 0.120115 -27.0135 -198.761 -22.2184 -70.7025 -23.5727 -49.3163 962.462 1.5706 315.817 -5.45619 188.563 -248.691 -11.5255 -93.0662 -4.2914 -16.5204 -4.56197 -37.771 4462.36 -28.7585 1450.11 -9.46481 -15.7848 -9.51666 458.45 4384.54 -68.6409 1453.02 -28.5761 13.8798 -24.4667 478.386 -5508.84 -466.603 -1924.9 -172.249 -478.847 -170.845 -701.847 -2991.51 2954.27 -0.97852 3.27777 3.07064 -5.20674 -13.6888 -0.298925 -17.7542 -1.19746 -7.00899 -1.73447 -5.14641 137.814 -1.38066 44.1777 -0.793201 25.2945 -132.262 3.75295 -43.6126 0.120948 -26.1372 -192.808 -21.5929 -68.5945 -22.9127 -47.8583 937.598 1.53513 307.668 -5.29935 183.701 -240.845 -11.2029 -90.168 -4.1713 -16.0582 -4.43439 -36.6173 4353.17 -27.9533 1414.75 -9.19979 -15.3323 -9.25026 447.354 4250 -66.8585 1408.4 -27.8228 13.4107 -23.8275 463.672 -5348.55 -453.495 -1869.01 -167.415 -465.457 -166.05 -681.544 -2900.34 2922.9 +6 0 1.55741 -3.57832 0.22272 10.8022 12.3737 -4.58554 27.9402 2.97192 10.3454 3.23154 6.72161 -151.715 2.73202 -49.3447 4.25862 -29.3075 1.34011 19.3984 1.39808 13.6047 -0.626035 411.509 19.5799 135.229 24.8461 86.1065 -842.591 9.67328 -274.578 13.4406 -164.261 377.021 27.1718 135.114 9.75003 29.4964 9.9149 51.3797 -4808.19 56.5879 -1577.85 18.5812 89.0219 18.5595 -509.166 -341.596 -366.274 -134.465 -126.69 -257.493 -122.891 -57.5829 11776.5 460.488 3899.67 165.732 540.994 162.276 1281.3 4523.94 400.514 1.48379 -3.55281 0.286068 10.438 12.1495 -4.49673 26.8981 2.88868 9.96894 3.14059 6.48092 -149.076 2.65542 -48.4999 4.13927 -28.8098 -0.0934058 18.8516 0.892724 13.2193 -0.893637 398.89 19.0127 131.074 24.1395 83.4696 -823.32 9.39329 -268.332 13.0588 -160.529 364.218 26.411 130.58 9.4772 28.6666 9.63735 49.6897 -4708.25 55.001 -1545.24 18.0601 86.5269 18.039 -498.77 -304.045 -355.934 -121.354 -123.114 -250.185 -119.422 -52.8435 11427.4 447.265 3783.94 160.978 525.663 157.618 1243.19 4377.86 268.448 +7 0 -0.263223 2.07819 5.86453 6.03726 2.20226 -12.6246 -4.47964 -0.672036 -1.80218 -0.890983 -1.72133 86.6006 -0.750988 28.5314 0.209832 16.4581 -218.668 11.5492 -72.3104 10.331 -40.1839 231.656 -4.2726 66.4385 2.27926 35.9462 -153.432 -24.5677 -63.6832 -17.0742 -45.1142 -56.5667 -6.15004 -21.8385 -2.66139 -8.31184 -2.86447 -9.25863 2712.91 -14.5836 898.621 -4.00123 5.99246 -4.05689 296.233 6098.91 -205.733 2025.47 -69.5878 -187.939 -67.5179 669.003 6679.14 -49.1716 2025.91 -55.247 71.5363 -46.0699 534.476 -631.558 5272.73 -0.268332 1.99028 5.73273 5.84258 2.18965 -12.2916 -4.46223 -0.654087 -1.78807 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-193.222 -92.3443 -72.3951 63.2383 -61.4157 -105.08 880.9 2198.74 +48 0 0.475391 -1.24088 1.2483 9.77749 10.7609 -8.55574 7.64359 0.148293 2.46758 0.991401 1.62368 -54.1561 -0.104315 -18.6026 1.19127 -11.2091 -58.7194 14.7958 -18.0748 13.7899 -9.57594 353.247 16.2591 118.28 4.42785 73.8353 -760.552 -6.848 -250.759 -1.09071 -152.414 93.202 1.32441 30.3027 0.24538 8.7248 0.460736 9.59077 -1749.31 -2.55354 -595.213 -0.862281 24.8914 -0.793025 -206.284 2001.76 -296.008 636.599 -107.508 -281.815 -98.9463 190.695 9625.59 347.955 3226.97 119.582 127.593 112.676 1088.1 1010.77 -513.687 0.422526 -1.30663 1.30955 9.42604 10.6306 -8.37612 7.0917 0.143794 2.28554 0.963045 1.50983 -54.8179 -0.102107 -18.8091 1.15662 -11.3333 -59.0826 14.3821 -18.239 13.4001 -9.71381 342.05 15.7894 114.53 4.28484 71.5027 -745.566 -6.66617 -245.845 -1.07216 -149.417 87.7017 1.28417 28.4878 0.237387 8.4753 0.446735 8.99815 -1747.54 -2.49745 -594.311 -0.843265 24.1667 -0.776039 -205.781 1987.81 -287.738 632.833 -104.506 -273.853 -96.1811 190.057 9334.03 337.959 3129.21 116.142 123.687 109.433 1055.13 957.697 -657.872 +49 0 -0.106133 -0.46653 -1.8279 0.559921 2.2356 1.30906 -2.08681 -0.487149 -1.03853 -0.0599119 -0.472893 -20.6531 -1.62717 -8.40464 -1.36823 -5.25746 59.5761 -0.123292 20.6667 2.90984 12.5251 23.1381 10.8803 7.0888 3.77366 3.38156 -158.747 8.31945 -56.4196 7.93576 -35.8774 -29.9015 -4.07181 -12.9429 -1.40085 -0.369062 -1.35955 -6.33408 -678.506 -34.6884 -258.589 -11.6941 -29.2997 -11.4763 -108.044 -1386.86 4.56855 -481.681 1.35148 -59.8938 1.39933 -172.274 726.463 191.072 228.387 66.7842 66.1808 64.0363 64.6141 -376.277 -2791.81 -0.114828 -0.481842 -1.75514 0.520085 2.22066 1.26186 -2.13415 -0.473898 -1.04462 -0.0585875 -0.480722 -20.6989 -1.58231 -8.37791 -1.33102 -5.23559 57.5481 -0.123717 19.9679 2.82659 12.0995 22.0353 10.5808 6.73865 3.66774 3.19506 -156.063 8.08627 -55.4312 7.71253 -35.2301 -30.0249 -3.96128 -12.9 -1.36276 -0.36191 -1.32251 -6.26276 -673.23 -33.7321 -255.935 -11.3718 -28.5033 -11.1599 -106.556 -1342.03 4.50376 -466.197 1.33839 -58.1946 1.38207 -166.784 697.509 185.807 219.121 64.9476 64.3167 62.2751 61.8469 -374.477 -2764.72 diff --git a/examples/PACKAGES/pod/Ta/pod.ldd.dat b/examples/PACKAGES/pod/Ta/pod.ldd.dat index 9b8bcb4be4..bc06cf7c61 100644 --- a/examples/PACKAGES/pod/Ta/pod.ldd.dat +++ b/examples/PACKAGES/pod/Ta/pod.ldd.dat @@ -1,3 +1,53 @@ # Time-averaged data for fix ldd # TimeStep Number-of-rows -# Row c_ldd[1] c_ldd[2] c_ldd[3] c_ldd[4] c_ldd[5] c_ldd[6] c_ldd[7] c_ldd[8] c_ldd[9] c_ldd[10] c_ldd[11] c_ldd[12] c_ldd[13] c_ldd[14] c_ldd[15] c_ldd[16] c_ldd[17] c_ldd[18] c_ldd[19] c_ldd[20] c_ldd[21] c_ldd[22] c_ldd[23] c_ldd[24] c_ldd[25] c_ldd[26] c_ldd[27] c_ldd[28] c_ldd[29] c_ldd[30] c_ldd[31] c_ldd[32] c_ldd[33] c_ldd[34] c_ldd[35] c_ldd[36] c_ldd[37] c_ldd[38] c_ldd[39] c_ldd[40] c_ldd[41] c_ldd[42] c_ldd[43] c_ldd[44] c_ldd[45] c_ldd[46] c_ldd[47] c_ldd[48] c_ldd[49] c_ldd[50] c_ldd[51] c_ldd[52] c_ldd[53] c_ldd[54] c_ldd[55] c_ldd[56] c_ldd[57] c_ldd[58] c_ldd[59] c_ldd[60] c_ldd[61] c_ldd[62] c_ldd[63] c_ldd[64] c_ldd[65] c_ldd[66] c_ldd[67] c_ldd[68] c_ldd[69] c_ldd[70] c_ldd[71] c_ldd[72] c_ldd[73] c_ldd[74] c_ldd[75] c_ldd[76] c_ldd[77] c_ldd[78] c_ldd[79] c_ldd[80] c_ldd[81] c_ldd[82] c_ldd[83] c_ldd[84] c_ldd[85] c_ldd[86] c_ldd[87] c_ldd[88] c_ldd[89] c_ldd[90] c_ldd[91] c_ldd[92] c_ldd[93] c_ldd[94] c_ldd[95] c_ldd[96] c_ldd[97] c_ldd[98] c_ldd[99] c_ldd[100] c_ldd[101] c_ldd[102] c_ldd[103] c_ldd[104] c_ldd[105] c_ldd[106] c_ldd[107] c_ldd[108] c_ldd[109] c_ldd[110] c_ldd[111] c_ldd[112] c_ldd[113] c_ldd[114] c_ldd[115] c_ldd[116] c_ldd[117] c_ldd[118] c_ldd[119] c_ldd[120] c_ldd[121] c_ldd[122] c_ldd[123] c_ldd[124] c_ldd[125] c_ldd[126] c_ldd[127] c_ldd[128] c_ldd[129] c_ldd[130] c_ldd[131] c_ldd[132] c_ldd[133] c_ldd[134] c_ldd[135] c_ldd[136] c_ldd[137] c_ldd[138] c_ldd[139] c_ldd[140] c_ldd[141] c_ldd[142] c_ldd[143] c_ldd[144] c_ldd[145] c_ldd[146] c_ldd[147] c_ldd[148] c_ldd[149] c_ldd[150] c_ldd[151] c_ldd[152] c_ldd[153] c_ldd[154] c_ldd[155] c_ldd[156] c_ldd[157] c_ldd[158] c_ldd[159] c_ldd[160] c_ldd[161] c_ldd[162] c_ldd[163] c_ldd[164] c_ldd[165] c_ldd[166] c_ldd[167] c_ldd[168] c_ldd[169] c_ldd[170] c_ldd[171] c_ldd[172] c_ldd[173] c_ldd[174] c_ldd[175] c_ldd[176] c_ldd[177] c_ldd[178] c_ldd[179] c_ldd[180] c_ldd[181] c_ldd[182] c_ldd[183] c_ldd[184] c_ldd[185] c_ldd[186] c_ldd[187] c_ldd[188] c_ldd[189] c_ldd[190] c_ldd[191] c_ldd[192] c_ldd[193] c_ldd[194] c_ldd[195] c_ldd[196] c_ldd[197] c_ldd[198] c_ldd[199] c_ldd[200] c_ldd[201] c_ldd[202] c_ldd[203] c_ldd[204] c_ldd[205] c_ldd[206] c_ldd[207] c_ldd[208] c_ldd[209] c_ldd[210] c_ldd[211] c_ldd[212] c_ldd[213] c_ldd[214] c_ldd[215] c_ldd[216] c_ldd[217] c_ldd[218] c_ldd[219] c_ldd[220] c_ldd[221] c_ldd[222] c_ldd[223] c_ldd[224] c_ldd[225] c_ldd[226] c_ldd[227] c_ldd[228] c_ldd[229] c_ldd[230] c_ldd[231] c_ldd[232] c_ldd[233] c_ldd[234] c_ldd[235] c_ldd[236] c_ldd[237] c_ldd[238] c_ldd[239] c_ldd[240] c_ldd[241] c_ldd[242] c_ldd[243] c_ldd[244] +# Row c_ldd[1] c_ldd[2] c_ldd[3] c_ldd[4] c_ldd[5] c_ldd[6] c_ldd[7] c_ldd[8] c_ldd[9] c_ldd[10] c_ldd[11] c_ldd[12] c_ldd[13] c_ldd[14] c_ldd[15] c_ldd[16] c_ldd[17] c_ldd[18] c_ldd[19] c_ldd[20] c_ldd[21] c_ldd[22] c_ldd[23] c_ldd[24] c_ldd[25] c_ldd[26] c_ldd[27] c_ldd[28] c_ldd[29] c_ldd[30] c_ldd[31] c_ldd[32] c_ldd[33] c_ldd[34] c_ldd[35] c_ldd[36] c_ldd[37] c_ldd[38] c_ldd[39] c_ldd[40] c_ldd[41] c_ldd[42] c_ldd[43] c_ldd[44] c_ldd[45] c_ldd[46] c_ldd[47] c_ldd[48] c_ldd[49] c_ldd[50] c_ldd[51] c_ldd[52] c_ldd[53] c_ldd[54] c_ldd[55] c_ldd[56] c_ldd[57] c_ldd[58] c_ldd[59] c_ldd[60] c_ldd[61] c_ldd[62] c_ldd[63] c_ldd[64] c_ldd[65] c_ldd[66] c_ldd[67] c_ldd[68] c_ldd[69] c_ldd[70] c_ldd[71] c_ldd[72] c_ldd[73] c_ldd[74] c_ldd[75] c_ldd[76] c_ldd[77] c_ldd[78] c_ldd[79] c_ldd[80] c_ldd[81] c_ldd[82] c_ldd[83] c_ldd[84] c_ldd[85] c_ldd[86] c_ldd[87] c_ldd[88] c_ldd[89] c_ldd[90] c_ldd[91] c_ldd[92] c_ldd[93] c_ldd[94] c_ldd[95] c_ldd[96] c_ldd[97] c_ldd[98] c_ldd[99] c_ldd[100] c_ldd[101] c_ldd[102] c_ldd[103] c_ldd[104] c_ldd[105] c_ldd[106] c_ldd[107] c_ldd[108] c_ldd[109] c_ldd[110] c_ldd[111] c_ldd[112] c_ldd[113] c_ldd[114] c_ldd[115] c_ldd[116] c_ldd[117] c_ldd[118] c_ldd[119] c_ldd[120] c_ldd[121] c_ldd[122] c_ldd[123] c_ldd[124] c_ldd[125] c_ldd[126] c_ldd[127] c_ldd[128] c_ldd[129] c_ldd[130] c_ldd[131] c_ldd[132] c_ldd[133] c_ldd[134] c_ldd[135] c_ldd[136] c_ldd[137] c_ldd[138] c_ldd[139] c_ldd[140] c_ldd[141] c_ldd[142] c_ldd[143] c_ldd[144] c_ldd[145] c_ldd[146] c_ldd[147] c_ldd[148] c_ldd[149] c_ldd[150] c_ldd[151] c_ldd[152] c_ldd[153] c_ldd[154] c_ldd[155] c_ldd[156] c_ldd[157] c_ldd[158] c_ldd[159] c_ldd[160] c_ldd[161] c_ldd[162] c_ldd[163] c_ldd[164] c_ldd[165] c_ldd[166] c_ldd[167] c_ldd[168] c_ldd[169] c_ldd[170] c_ldd[171] c_ldd[172] c_ldd[173] c_ldd[174] c_ldd[175] c_ldd[176] c_ldd[177] c_ldd[178] c_ldd[179] c_ldd[180] c_ldd[181] c_ldd[182] c_ldd[183] c_ldd[184] c_ldd[185] c_ldd[186] c_ldd[187] c_ldd[188] c_ldd[189] c_ldd[190] c_ldd[191] c_ldd[192] c_ldd[193] c_ldd[194] c_ldd[195] c_ldd[196] c_ldd[197] c_ldd[198] c_ldd[199] c_ldd[200] c_ldd[201] c_ldd[202] c_ldd[203] c_ldd[204] c_ldd[205] c_ldd[206] c_ldd[207] c_ldd[208] c_ldd[209] c_ldd[210] c_ldd[211] c_ldd[212] c_ldd[213] c_ldd[214] c_ldd[215] c_ldd[216] c_ldd[217] c_ldd[218] c_ldd[219] c_ldd[220] c_ldd[221] c_ldd[222] c_ldd[223] c_ldd[224] c_ldd[225] c_ldd[226] c_ldd[227] c_ldd[228] c_ldd[229] c_ldd[230] c_ldd[231] c_ldd[232] c_ldd[233] c_ldd[234] c_ldd[235] c_ldd[236] c_ldd[237] c_ldd[238] c_ldd[239] c_ldd[240] c_ldd[241] c_ldd[242] c_ldd[243] c_ldd[244] c_ldd[245] c_ldd[246] c_ldd[247] c_ldd[248] c_ldd[249] c_ldd[250] c_ldd[251] c_ldd[252] c_ldd[253] c_ldd[254] c_ldd[255] c_ldd[256] c_ldd[257] c_ldd[258] c_ldd[259] c_ldd[260] c_ldd[261] c_ldd[262] c_ldd[263] c_ldd[264] c_ldd[265] c_ldd[266] c_ldd[267] c_ldd[268] c_ldd[269] c_ldd[270] c_ldd[271] c_ldd[272] c_ldd[273] c_ldd[274] c_ldd[275] c_ldd[276] c_ldd[277] c_ldd[278] c_ldd[279] c_ldd[280] c_ldd[281] c_ldd[282] c_ldd[283] c_ldd[284] c_ldd[285] c_ldd[286] c_ldd[287] c_ldd[288] c_ldd[289] c_ldd[290] c_ldd[291] c_ldd[292] c_ldd[293] c_ldd[294] c_ldd[295] c_ldd[296] c_ldd[297] c_ldd[298] c_ldd[299] c_ldd[300] c_ldd[301] c_ldd[302] c_ldd[303] c_ldd[304] c_ldd[305] c_ldd[306] c_ldd[307] c_ldd[308] c_ldd[309] c_ldd[310] c_ldd[311] c_ldd[312] c_ldd[313] c_ldd[314] c_ldd[315] c_ldd[316] c_ldd[317] c_ldd[318] c_ldd[319] c_ldd[320] c_ldd[321] c_ldd[322] c_ldd[323] c_ldd[324] c_ldd[325] c_ldd[326] c_ldd[327] c_ldd[328] c_ldd[329] c_ldd[330] c_ldd[331] c_ldd[332] c_ldd[333] c_ldd[334] c_ldd[335] c_ldd[336] c_ldd[337] c_ldd[338] c_ldd[339] c_ldd[340] c_ldd[341] c_ldd[342] c_ldd[343] c_ldd[344] c_ldd[345] c_ldd[346] c_ldd[347] c_ldd[348] c_ldd[349] c_ldd[350] c_ldd[351] c_ldd[352] c_ldd[353] c_ldd[354] c_ldd[355] c_ldd[356] c_ldd[357] c_ldd[358] c_ldd[359] c_ldd[360] c_ldd[361] c_ldd[362] c_ldd[363] c_ldd[364] c_ldd[365] c_ldd[366] c_ldd[367] c_ldd[368] c_ldd[369] c_ldd[370] c_ldd[371] c_ldd[372] c_ldd[373] c_ldd[374] c_ldd[375] c_ldd[376] c_ldd[377] c_ldd[378] c_ldd[379] c_ldd[380] c_ldd[381] c_ldd[382] c_ldd[383] c_ldd[384] c_ldd[385] c_ldd[386] c_ldd[387] c_ldd[388] c_ldd[389] c_ldd[390] c_ldd[391] c_ldd[392] c_ldd[393] c_ldd[394] c_ldd[395] c_ldd[396] c_ldd[397] c_ldd[398] c_ldd[399] c_ldd[400] c_ldd[401] c_ldd[402] c_ldd[403] c_ldd[404] c_ldd[405] c_ldd[406] c_ldd[407] c_ldd[408] c_ldd[409] c_ldd[410] c_ldd[411] c_ldd[412] c_ldd[413] c_ldd[414] c_ldd[415] c_ldd[416] c_ldd[417] c_ldd[418] c_ldd[419] c_ldd[420] c_ldd[421] c_ldd[422] c_ldd[423] c_ldd[424] c_ldd[425] c_ldd[426] c_ldd[427] c_ldd[428] c_ldd[429] c_ldd[430] c_ldd[431] c_ldd[432] c_ldd[433] c_ldd[434] c_ldd[435] c_ldd[436] c_ldd[437] c_ldd[438] c_ldd[439] c_ldd[440] c_ldd[441] c_ldd[442] c_ldd[443] c_ldd[444] c_ldd[445] c_ldd[446] c_ldd[447] c_ldd[448] c_ldd[449] c_ldd[450] c_ldd[451] c_ldd[452] c_ldd[453] c_ldd[454] c_ldd[455] c_ldd[456] c_ldd[457] c_ldd[458] c_ldd[459] c_ldd[460] c_ldd[461] c_ldd[462] c_ldd[463] c_ldd[464] c_ldd[465] c_ldd[466] c_ldd[467] c_ldd[468] c_ldd[469] c_ldd[470] c_ldd[471] c_ldd[472] c_ldd[473] c_ldd[474] c_ldd[475] c_ldd[476] c_ldd[477] c_ldd[478] c_ldd[479] c_ldd[480] c_ldd[481] c_ldd[482] c_ldd[483] c_ldd[484] c_ldd[485] c_ldd[486] c_ldd[487] c_ldd[488] c_ldd[489] c_ldd[490] c_ldd[491] c_ldd[492] c_ldd[493] c_ldd[494] c_ldd[495] c_ldd[496] c_ldd[497] c_ldd[498] c_ldd[499] c_ldd[500] c_ldd[501] c_ldd[502] c_ldd[503] c_ldd[504] c_ldd[505] c_ldd[506] c_ldd[507] c_ldd[508] c_ldd[509] c_ldd[510] c_ldd[511] c_ldd[512] c_ldd[513] c_ldd[514] c_ldd[515] c_ldd[516] c_ldd[517] c_ldd[518] c_ldd[519] c_ldd[520] c_ldd[521] c_ldd[522] c_ldd[523] c_ldd[524] c_ldd[525] c_ldd[526] c_ldd[527] c_ldd[528] c_ldd[529] c_ldd[530] c_ldd[531] c_ldd[532] c_ldd[533] c_ldd[534] c_ldd[535] c_ldd[536] c_ldd[537] c_ldd[538] c_ldd[539] c_ldd[540] c_ldd[541] c_ldd[542] c_ldd[543] c_ldd[544] c_ldd[545] c_ldd[546] c_ldd[547] c_ldd[548] c_ldd[549] c_ldd[550] c_ldd[551] c_ldd[552] c_ldd[553] c_ldd[554] c_ldd[555] c_ldd[556] c_ldd[557] c_ldd[558] c_ldd[559] c_ldd[560] c_ldd[561] c_ldd[562] c_ldd[563] c_ldd[564] c_ldd[565] c_ldd[566] c_ldd[567] c_ldd[568] c_ldd[569] c_ldd[570] c_ldd[571] c_ldd[572] c_ldd[573] c_ldd[574] c_ldd[575] c_ldd[576] c_ldd[577] c_ldd[578] c_ldd[579] c_ldd[580] c_ldd[581] c_ldd[582] c_ldd[583] c_ldd[584] c_ldd[585] c_ldd[586] c_ldd[587] c_ldd[588] c_ldd[589] c_ldd[590] c_ldd[591] c_ldd[592] c_ldd[593] c_ldd[594] c_ldd[595] c_ldd[596] c_ldd[597] c_ldd[598] c_ldd[599] c_ldd[600] c_ldd[601] c_ldd[602] c_ldd[603] c_ldd[604] c_ldd[605] c_ldd[606] c_ldd[607] c_ldd[608] c_ldd[609] c_ldd[610] c_ldd[611] c_ldd[612] c_ldd[613] c_ldd[614] c_ldd[615] c_ldd[616] c_ldd[617] c_ldd[618] c_ldd[619] c_ldd[620] c_ldd[621] c_ldd[622] c_ldd[623] c_ldd[624] c_ldd[625] c_ldd[626] c_ldd[627] c_ldd[628] c_ldd[629] c_ldd[630] c_ldd[631] c_ldd[632] c_ldd[633] c_ldd[634] c_ldd[635] c_ldd[636] c_ldd[637] c_ldd[638] c_ldd[639] c_ldd[640] c_ldd[641] c_ldd[642] c_ldd[643] c_ldd[644] c_ldd[645] c_ldd[646] c_ldd[647] c_ldd[648] c_ldd[649] c_ldd[650] c_ldd[651] c_ldd[652] c_ldd[653] c_ldd[654] c_ldd[655] c_ldd[656] c_ldd[657] c_ldd[658] c_ldd[659] c_ldd[660] c_ldd[661] c_ldd[662] c_ldd[663] c_ldd[664] c_ldd[665] c_ldd[666] c_ldd[667] c_ldd[668] c_ldd[669] c_ldd[670] c_ldd[671] c_ldd[672] c_ldd[673] c_ldd[674] c_ldd[675] c_ldd[676] c_ldd[677] c_ldd[678] c_ldd[679] c_ldd[680] c_ldd[681] c_ldd[682] c_ldd[683] c_ldd[684] c_ldd[685] c_ldd[686] c_ldd[687] c_ldd[688] c_ldd[689] c_ldd[690] c_ldd[691] c_ldd[692] c_ldd[693] c_ldd[694] c_ldd[695] c_ldd[696] c_ldd[697] c_ldd[698] c_ldd[699] c_ldd[700] c_ldd[701] c_ldd[702] c_ldd[703] c_ldd[704] c_ldd[705] c_ldd[706] c_ldd[707] c_ldd[708] c_ldd[709] c_ldd[710] c_ldd[711] c_ldd[712] c_ldd[713] c_ldd[714] c_ldd[715] c_ldd[716] c_ldd[717] c_ldd[718] c_ldd[719] c_ldd[720] c_ldd[721] c_ldd[722] c_ldd[723] c_ldd[724] c_ldd[725] c_ldd[726] c_ldd[727] c_ldd[728] c_ldd[729] c_ldd[730] c_ldd[731] c_ldd[732] c_ldd[733] c_ldd[734] c_ldd[735] c_ldd[736] c_ldd[737] c_ldd[738] c_ldd[739] c_ldd[740] c_ldd[741] c_ldd[742] c_ldd[743] c_ldd[744] c_ldd[745] c_ldd[746] c_ldd[747] c_ldd[748] c_ldd[749] c_ldd[750] c_ldd[751] c_ldd[752] c_ldd[753] c_ldd[754] c_ldd[755] c_ldd[756] c_ldd[757] c_ldd[758] c_ldd[759] c_ldd[760] c_ldd[761] c_ldd[762] c_ldd[763] c_ldd[764] c_ldd[765] c_ldd[766] c_ldd[767] c_ldd[768] c_ldd[769] c_ldd[770] c_ldd[771] c_ldd[772] c_ldd[773] c_ldd[774] c_ldd[775] c_ldd[776] c_ldd[777] c_ldd[778] c_ldd[779] c_ldd[780] c_ldd[781] c_ldd[782] c_ldd[783] c_ldd[784] c_ldd[785] c_ldd[786] c_ldd[787] c_ldd[788] c_ldd[789] c_ldd[790] c_ldd[791] c_ldd[792] c_ldd[793] c_ldd[794] c_ldd[795] c_ldd[796] c_ldd[797] c_ldd[798] c_ldd[799] c_ldd[800] c_ldd[801] c_ldd[802] c_ldd[803] c_ldd[804] c_ldd[805] c_ldd[806] c_ldd[807] c_ldd[808] c_ldd[809] c_ldd[810] c_ldd[811] c_ldd[812] c_ldd[813] c_ldd[814] c_ldd[815] c_ldd[816] c_ldd[817] c_ldd[818] c_ldd[819] c_ldd[820] c_ldd[821] c_ldd[822] c_ldd[823] c_ldd[824] c_ldd[825] c_ldd[826] c_ldd[827] c_ldd[828] c_ldd[829] c_ldd[830] c_ldd[831] c_ldd[832] c_ldd[833] c_ldd[834] c_ldd[835] c_ldd[836] c_ldd[837] c_ldd[838] c_ldd[839] c_ldd[840] c_ldd[841] c_ldd[842] c_ldd[843] c_ldd[844] c_ldd[845] c_ldd[846] c_ldd[847] c_ldd[848] c_ldd[849] c_ldd[850] c_ldd[851] c_ldd[852] c_ldd[853] c_ldd[854] c_ldd[855] c_ldd[856] c_ldd[857] c_ldd[858] c_ldd[859] c_ldd[860] c_ldd[861] c_ldd[862] c_ldd[863] c_ldd[864] c_ldd[865] c_ldd[866] c_ldd[867] c_ldd[868] c_ldd[869] c_ldd[870] c_ldd[871] c_ldd[872] c_ldd[873] c_ldd[874] c_ldd[875] c_ldd[876] c_ldd[877] c_ldd[878] c_ldd[879] c_ldd[880] c_ldd[881] c_ldd[882] c_ldd[883] c_ldd[884] c_ldd[885] c_ldd[886] c_ldd[887] c_ldd[888] c_ldd[889] c_ldd[890] c_ldd[891] c_ldd[892] c_ldd[893] c_ldd[894] c_ldd[895] c_ldd[896] c_ldd[897] c_ldd[898] c_ldd[899] c_ldd[900] c_ldd[901] c_ldd[902] c_ldd[903] c_ldd[904] c_ldd[905] c_ldd[906] c_ldd[907] c_ldd[908] c_ldd[909] c_ldd[910] c_ldd[911] c_ldd[912] c_ldd[913] c_ldd[914] c_ldd[915] c_ldd[916] c_ldd[917] c_ldd[918] c_ldd[919] c_ldd[920] c_ldd[921] c_ldd[922] c_ldd[923] c_ldd[924] c_ldd[925] c_ldd[926] c_ldd[927] c_ldd[928] c_ldd[929] c_ldd[930] c_ldd[931] c_ldd[932] c_ldd[933] c_ldd[934] c_ldd[935] c_ldd[936] c_ldd[937] c_ldd[938] c_ldd[939] c_ldd[940] c_ldd[941] c_ldd[942] c_ldd[943] c_ldd[944] c_ldd[945] c_ldd[946] c_ldd[947] c_ldd[948] c_ldd[949] c_ldd[950] c_ldd[951] c_ldd[952] c_ldd[953] c_ldd[954] c_ldd[955] c_ldd[956] c_ldd[957] c_ldd[958] c_ldd[959] c_ldd[960] c_ldd[961] c_ldd[962] c_ldd[963] c_ldd[964] c_ldd[965] c_ldd[966] c_ldd[967] c_ldd[968] c_ldd[969] c_ldd[970] c_ldd[971] c_ldd[972] c_ldd[973] c_ldd[974] c_ldd[975] c_ldd[976] c_ldd[977] c_ldd[978] c_ldd[979] c_ldd[980] c_ldd[981] c_ldd[982] c_ldd[983] c_ldd[984] c_ldd[985] c_ldd[986] c_ldd[987] c_ldd[988] c_ldd[989] c_ldd[990] c_ldd[991] c_ldd[992] c_ldd[993] c_ldd[994] c_ldd[995] c_ldd[996] c_ldd[997] c_ldd[998] c_ldd[999] c_ldd[1000] c_ldd[1001] c_ldd[1002] c_ldd[1003] c_ldd[1004] c_ldd[1005] c_ldd[1006] c_ldd[1007] c_ldd[1008] c_ldd[1009] c_ldd[1010] c_ldd[1011] c_ldd[1012] c_ldd[1013] c_ldd[1014] c_ldd[1015] c_ldd[1016] c_ldd[1017] c_ldd[1018] c_ldd[1019] c_ldd[1020] c_ldd[1021] c_ldd[1022] c_ldd[1023] c_ldd[1024] c_ldd[1025] c_ldd[1026] c_ldd[1027] c_ldd[1028] c_ldd[1029] c_ldd[1030] c_ldd[1031] c_ldd[1032] c_ldd[1033] c_ldd[1034] c_ldd[1035] c_ldd[1036] c_ldd[1037] c_ldd[1038] c_ldd[1039] c_ldd[1040] c_ldd[1041] c_ldd[1042] c_ldd[1043] c_ldd[1044] c_ldd[1045] c_ldd[1046] c_ldd[1047] c_ldd[1048] c_ldd[1049] c_ldd[1050] c_ldd[1051] c_ldd[1052] c_ldd[1053] c_ldd[1054] c_ldd[1055] c_ldd[1056] c_ldd[1057] c_ldd[1058] c_ldd[1059] c_ldd[1060] c_ldd[1061] c_ldd[1062] c_ldd[1063] c_ldd[1064] c_ldd[1065] c_ldd[1066] c_ldd[1067] c_ldd[1068] c_ldd[1069] c_ldd[1070] c_ldd[1071] c_ldd[1072] c_ldd[1073] c_ldd[1074] c_ldd[1075] c_ldd[1076] c_ldd[1077] c_ldd[1078] c_ldd[1079] c_ldd[1080] c_ldd[1081] c_ldd[1082] c_ldd[1083] c_ldd[1084] c_ldd[1085] c_ldd[1086] c_ldd[1087] c_ldd[1088] c_ldd[1089] c_ldd[1090] c_ldd[1091] c_ldd[1092] c_ldd[1093] c_ldd[1094] c_ldd[1095] c_ldd[1096] c_ldd[1097] c_ldd[1098] c_ldd[1099] c_ldd[1100] c_ldd[1101] c_ldd[1102] c_ldd[1103] c_ldd[1104] c_ldd[1105] c_ldd[1106] c_ldd[1107] c_ldd[1108] c_ldd[1109] c_ldd[1110] c_ldd[1111] c_ldd[1112] c_ldd[1113] c_ldd[1114] c_ldd[1115] c_ldd[1116] c_ldd[1117] c_ldd[1118] c_ldd[1119] c_ldd[1120] c_ldd[1121] c_ldd[1122] c_ldd[1123] c_ldd[1124] c_ldd[1125] c_ldd[1126] c_ldd[1127] c_ldd[1128] c_ldd[1129] c_ldd[1130] c_ldd[1131] c_ldd[1132] c_ldd[1133] c_ldd[1134] c_ldd[1135] c_ldd[1136] c_ldd[1137] c_ldd[1138] c_ldd[1139] c_ldd[1140] c_ldd[1141] c_ldd[1142] c_ldd[1143] c_ldd[1144] c_ldd[1145] c_ldd[1146] c_ldd[1147] c_ldd[1148] c_ldd[1149] c_ldd[1150] c_ldd[1151] c_ldd[1152] c_ldd[1153] c_ldd[1154] c_ldd[1155] c_ldd[1156] c_ldd[1157] c_ldd[1158] c_ldd[1159] c_ldd[1160] c_ldd[1161] c_ldd[1162] c_ldd[1163] c_ldd[1164] c_ldd[1165] c_ldd[1166] c_ldd[1167] c_ldd[1168] c_ldd[1169] c_ldd[1170] c_ldd[1171] c_ldd[1172] c_ldd[1173] c_ldd[1174] c_ldd[1175] c_ldd[1176] c_ldd[1177] c_ldd[1178] c_ldd[1179] c_ldd[1180] c_ldd[1181] c_ldd[1182] c_ldd[1183] c_ldd[1184] c_ldd[1185] c_ldd[1186] c_ldd[1187] c_ldd[1188] c_ldd[1189] c_ldd[1190] c_ldd[1191] c_ldd[1192] c_ldd[1193] c_ldd[1194] c_ldd[1195] c_ldd[1196] c_ldd[1197] c_ldd[1198] c_ldd[1199] c_ldd[1200] c_ldd[1201] c_ldd[1202] c_ldd[1203] c_ldd[1204] c_ldd[1205] c_ldd[1206] c_ldd[1207] c_ldd[1208] c_ldd[1209] c_ldd[1210] c_ldd[1211] c_ldd[1212] c_ldd[1213] c_ldd[1214] c_ldd[1215] c_ldd[1216] c_ldd[1217] c_ldd[1218] c_ldd[1219] c_ldd[1220] c_ldd[1221] c_ldd[1222] c_ldd[1223] c_ldd[1224] c_ldd[1225] c_ldd[1226] c_ldd[1227] c_ldd[1228] c_ldd[1229] c_ldd[1230] c_ldd[1231] c_ldd[1232] c_ldd[1233] c_ldd[1234] c_ldd[1235] c_ldd[1236] c_ldd[1237] c_ldd[1238] c_ldd[1239] c_ldd[1240] c_ldd[1241] c_ldd[1242] c_ldd[1243] c_ldd[1244] c_ldd[1245] c_ldd[1246] c_ldd[1247] c_ldd[1248] c_ldd[1249] c_ldd[1250] c_ldd[1251] c_ldd[1252] c_ldd[1253] c_ldd[1254] c_ldd[1255] c_ldd[1256] c_ldd[1257] c_ldd[1258] c_ldd[1259] c_ldd[1260] c_ldd[1261] c_ldd[1262] c_ldd[1263] c_ldd[1264] c_ldd[1265] c_ldd[1266] c_ldd[1267] c_ldd[1268] c_ldd[1269] c_ldd[1270] c_ldd[1271] c_ldd[1272] c_ldd[1273] c_ldd[1274] c_ldd[1275] c_ldd[1276] c_ldd[1277] c_ldd[1278] c_ldd[1279] c_ldd[1280] c_ldd[1281] c_ldd[1282] c_ldd[1283] c_ldd[1284] c_ldd[1285] c_ldd[1286] c_ldd[1287] c_ldd[1288] c_ldd[1289] c_ldd[1290] c_ldd[1291] c_ldd[1292] c_ldd[1293] c_ldd[1294] c_ldd[1295] c_ldd[1296] c_ldd[1297] c_ldd[1298] c_ldd[1299] c_ldd[1300] c_ldd[1301] c_ldd[1302] c_ldd[1303] c_ldd[1304] c_ldd[1305] c_ldd[1306] c_ldd[1307] c_ldd[1308] c_ldd[1309] c_ldd[1310] c_ldd[1311] c_ldd[1312] c_ldd[1313] c_ldd[1314] c_ldd[1315] c_ldd[1316] c_ldd[1317] c_ldd[1318] c_ldd[1319] c_ldd[1320] c_ldd[1321] c_ldd[1322] c_ldd[1323] c_ldd[1324] c_ldd[1325] c_ldd[1326] c_ldd[1327] c_ldd[1328] c_ldd[1329] c_ldd[1330] c_ldd[1331] c_ldd[1332] c_ldd[1333] c_ldd[1334] c_ldd[1335] c_ldd[1336] c_ldd[1337] c_ldd[1338] c_ldd[1339] c_ldd[1340] c_ldd[1341] c_ldd[1342] c_ldd[1343] c_ldd[1344] c_ldd[1345] c_ldd[1346] c_ldd[1347] c_ldd[1348] c_ldd[1349] c_ldd[1350] c_ldd[1351] c_ldd[1352] c_ldd[1353] c_ldd[1354] c_ldd[1355] c_ldd[1356] c_ldd[1357] c_ldd[1358] c_ldd[1359] c_ldd[1360] c_ldd[1361] c_ldd[1362] c_ldd[1363] c_ldd[1364] c_ldd[1365] c_ldd[1366] c_ldd[1367] c_ldd[1368] c_ldd[1369] c_ldd[1370] c_ldd[1371] c_ldd[1372] c_ldd[1373] c_ldd[1374] c_ldd[1375] c_ldd[1376] c_ldd[1377] c_ldd[1378] c_ldd[1379] c_ldd[1380] c_ldd[1381] c_ldd[1382] c_ldd[1383] c_ldd[1384] c_ldd[1385] c_ldd[1386] c_ldd[1387] c_ldd[1388] c_ldd[1389] c_ldd[1390] c_ldd[1391] c_ldd[1392] c_ldd[1393] c_ldd[1394] c_ldd[1395] c_ldd[1396] c_ldd[1397] c_ldd[1398] c_ldd[1399] c_ldd[1400] c_ldd[1401] c_ldd[1402] c_ldd[1403] c_ldd[1404] c_ldd[1405] c_ldd[1406] c_ldd[1407] c_ldd[1408] c_ldd[1409] c_ldd[1410] c_ldd[1411] c_ldd[1412] c_ldd[1413] c_ldd[1414] c_ldd[1415] c_ldd[1416] c_ldd[1417] c_ldd[1418] c_ldd[1419] c_ldd[1420] c_ldd[1421] c_ldd[1422] c_ldd[1423] c_ldd[1424] c_ldd[1425] c_ldd[1426] c_ldd[1427] c_ldd[1428] c_ldd[1429] c_ldd[1430] c_ldd[1431] c_ldd[1432] c_ldd[1433] c_ldd[1434] c_ldd[1435] c_ldd[1436] c_ldd[1437] c_ldd[1438] c_ldd[1439] c_ldd[1440] c_ldd[1441] c_ldd[1442] c_ldd[1443] c_ldd[1444] c_ldd[1445] c_ldd[1446] c_ldd[1447] c_ldd[1448] c_ldd[1449] c_ldd[1450] c_ldd[1451] c_ldd[1452] c_ldd[1453] c_ldd[1454] c_ldd[1455] c_ldd[1456] c_ldd[1457] c_ldd[1458] c_ldd[1459] c_ldd[1460] c_ldd[1461] c_ldd[1462] c_ldd[1463] c_ldd[1464] c_ldd[1465] c_ldd[1466] c_ldd[1467] c_ldd[1468] c_ldd[1469] c_ldd[1470] c_ldd[1471] c_ldd[1472] c_ldd[1473] c_ldd[1474] c_ldd[1475] c_ldd[1476] c_ldd[1477] c_ldd[1478] c_ldd[1479] c_ldd[1480] c_ldd[1481] c_ldd[1482] c_ldd[1483] c_ldd[1484] c_ldd[1485] c_ldd[1486] c_ldd[1487] c_ldd[1488] c_ldd[1489] c_ldd[1490] c_ldd[1491] c_ldd[1492] c_ldd[1493] c_ldd[1494] c_ldd[1495] c_ldd[1496] c_ldd[1497] c_ldd[1498] c_ldd[1499] c_ldd[1500] c_ldd[1501] c_ldd[1502] c_ldd[1503] c_ldd[1504] c_ldd[1505] c_ldd[1506] c_ldd[1507] c_ldd[1508] c_ldd[1509] c_ldd[1510] c_ldd[1511] c_ldd[1512] c_ldd[1513] c_ldd[1514] c_ldd[1515] c_ldd[1516] c_ldd[1517] c_ldd[1518] c_ldd[1519] c_ldd[1520] c_ldd[1521] c_ldd[1522] c_ldd[1523] c_ldd[1524] c_ldd[1525] c_ldd[1526] c_ldd[1527] c_ldd[1528] c_ldd[1529] c_ldd[1530] c_ldd[1531] c_ldd[1532] c_ldd[1533] c_ldd[1534] c_ldd[1535] c_ldd[1536] c_ldd[1537] c_ldd[1538] c_ldd[1539] c_ldd[1540] c_ldd[1541] c_ldd[1542] c_ldd[1543] c_ldd[1544] c_ldd[1545] c_ldd[1546] c_ldd[1547] c_ldd[1548] c_ldd[1549] c_ldd[1550] c_ldd[1551] c_ldd[1552] c_ldd[1553] c_ldd[1554] c_ldd[1555] c_ldd[1556] c_ldd[1557] c_ldd[1558] c_ldd[1559] c_ldd[1560] c_ldd[1561] c_ldd[1562] c_ldd[1563] c_ldd[1564] c_ldd[1565] c_ldd[1566] c_ldd[1567] c_ldd[1568] c_ldd[1569] c_ldd[1570] c_ldd[1571] c_ldd[1572] c_ldd[1573] c_ldd[1574] c_ldd[1575] c_ldd[1576] c_ldd[1577] c_ldd[1578] c_ldd[1579] c_ldd[1580] c_ldd[1581] c_ldd[1582] c_ldd[1583] c_ldd[1584] c_ldd[1585] c_ldd[1586] c_ldd[1587] c_ldd[1588] c_ldd[1589] c_ldd[1590] c_ldd[1591] c_ldd[1592] c_ldd[1593] c_ldd[1594] c_ldd[1595] c_ldd[1596] c_ldd[1597] c_ldd[1598] c_ldd[1599] c_ldd[1600] c_ldd[1601] c_ldd[1602] c_ldd[1603] c_ldd[1604] c_ldd[1605] c_ldd[1606] c_ldd[1607] c_ldd[1608] c_ldd[1609] c_ldd[1610] c_ldd[1611] c_ldd[1612] c_ldd[1613] c_ldd[1614] c_ldd[1615] c_ldd[1616] c_ldd[1617] c_ldd[1618] c_ldd[1619] c_ldd[1620] c_ldd[1621] c_ldd[1622] c_ldd[1623] c_ldd[1624] c_ldd[1625] c_ldd[1626] c_ldd[1627] c_ldd[1628] c_ldd[1629] c_ldd[1630] c_ldd[1631] c_ldd[1632] c_ldd[1633] c_ldd[1634] c_ldd[1635] c_ldd[1636] c_ldd[1637] c_ldd[1638] c_ldd[1639] c_ldd[1640] c_ldd[1641] c_ldd[1642] c_ldd[1643] c_ldd[1644] c_ldd[1645] c_ldd[1646] c_ldd[1647] c_ldd[1648] c_ldd[1649] c_ldd[1650] c_ldd[1651] c_ldd[1652] c_ldd[1653] c_ldd[1654] c_ldd[1655] c_ldd[1656] c_ldd[1657] c_ldd[1658] c_ldd[1659] c_ldd[1660] c_ldd[1661] c_ldd[1662] c_ldd[1663] c_ldd[1664] c_ldd[1665] c_ldd[1666] c_ldd[1667] c_ldd[1668] c_ldd[1669] c_ldd[1670] c_ldd[1671] c_ldd[1672] c_ldd[1673] c_ldd[1674] c_ldd[1675] c_ldd[1676] c_ldd[1677] c_ldd[1678] c_ldd[1679] c_ldd[1680] c_ldd[1681] c_ldd[1682] c_ldd[1683] c_ldd[1684] c_ldd[1685] c_ldd[1686] c_ldd[1687] c_ldd[1688] c_ldd[1689] c_ldd[1690] c_ldd[1691] c_ldd[1692] c_ldd[1693] c_ldd[1694] c_ldd[1695] c_ldd[1696] c_ldd[1697] c_ldd[1698] c_ldd[1699] c_ldd[1700] c_ldd[1701] c_ldd[1702] c_ldd[1703] c_ldd[1704] c_ldd[1705] c_ldd[1706] c_ldd[1707] c_ldd[1708] c_ldd[1709] c_ldd[1710] c_ldd[1711] c_ldd[1712] c_ldd[1713] c_ldd[1714] c_ldd[1715] c_ldd[1716] c_ldd[1717] c_ldd[1718] c_ldd[1719] c_ldd[1720] c_ldd[1721] c_ldd[1722] c_ldd[1723] c_ldd[1724] c_ldd[1725] c_ldd[1726] c_ldd[1727] c_ldd[1728] c_ldd[1729] c_ldd[1730] c_ldd[1731] c_ldd[1732] c_ldd[1733] c_ldd[1734] c_ldd[1735] c_ldd[1736] c_ldd[1737] c_ldd[1738] c_ldd[1739] c_ldd[1740] c_ldd[1741] c_ldd[1742] c_ldd[1743] c_ldd[1744] c_ldd[1745] c_ldd[1746] c_ldd[1747] c_ldd[1748] c_ldd[1749] c_ldd[1750] c_ldd[1751] c_ldd[1752] c_ldd[1753] c_ldd[1754] c_ldd[1755] c_ldd[1756] c_ldd[1757] c_ldd[1758] c_ldd[1759] c_ldd[1760] c_ldd[1761] c_ldd[1762] c_ldd[1763] c_ldd[1764] c_ldd[1765] c_ldd[1766] c_ldd[1767] c_ldd[1768] c_ldd[1769] c_ldd[1770] c_ldd[1771] c_ldd[1772] c_ldd[1773] c_ldd[1774] c_ldd[1775] c_ldd[1776] c_ldd[1777] c_ldd[1778] c_ldd[1779] c_ldd[1780] c_ldd[1781] c_ldd[1782] c_ldd[1783] c_ldd[1784] c_ldd[1785] c_ldd[1786] c_ldd[1787] c_ldd[1788] c_ldd[1789] c_ldd[1790] c_ldd[1791] c_ldd[1792] c_ldd[1793] c_ldd[1794] c_ldd[1795] c_ldd[1796] c_ldd[1797] c_ldd[1798] c_ldd[1799] c_ldd[1800] c_ldd[1801] c_ldd[1802] c_ldd[1803] c_ldd[1804] c_ldd[1805] c_ldd[1806] c_ldd[1807] c_ldd[1808] c_ldd[1809] c_ldd[1810] c_ldd[1811] c_ldd[1812] c_ldd[1813] c_ldd[1814] c_ldd[1815] c_ldd[1816] c_ldd[1817] c_ldd[1818] c_ldd[1819] c_ldd[1820] c_ldd[1821] c_ldd[1822] c_ldd[1823] c_ldd[1824] c_ldd[1825] c_ldd[1826] c_ldd[1827] c_ldd[1828] c_ldd[1829] c_ldd[1830] c_ldd[1831] c_ldd[1832] c_ldd[1833] c_ldd[1834] c_ldd[1835] c_ldd[1836] c_ldd[1837] c_ldd[1838] c_ldd[1839] c_ldd[1840] c_ldd[1841] c_ldd[1842] c_ldd[1843] c_ldd[1844] c_ldd[1845] c_ldd[1846] c_ldd[1847] c_ldd[1848] c_ldd[1849] c_ldd[1850] c_ldd[1851] c_ldd[1852] c_ldd[1853] c_ldd[1854] c_ldd[1855] c_ldd[1856] c_ldd[1857] c_ldd[1858] c_ldd[1859] c_ldd[1860] c_ldd[1861] c_ldd[1862] c_ldd[1863] c_ldd[1864] c_ldd[1865] c_ldd[1866] c_ldd[1867] c_ldd[1868] c_ldd[1869] c_ldd[1870] c_ldd[1871] c_ldd[1872] c_ldd[1873] c_ldd[1874] c_ldd[1875] c_ldd[1876] c_ldd[1877] c_ldd[1878] c_ldd[1879] c_ldd[1880] c_ldd[1881] c_ldd[1882] c_ldd[1883] c_ldd[1884] c_ldd[1885] c_ldd[1886] c_ldd[1887] c_ldd[1888] c_ldd[1889] c_ldd[1890] c_ldd[1891] c_ldd[1892] c_ldd[1893] c_ldd[1894] c_ldd[1895] c_ldd[1896] c_ldd[1897] c_ldd[1898] c_ldd[1899] c_ldd[1900] c_ldd[1901] c_ldd[1902] c_ldd[1903] c_ldd[1904] c_ldd[1905] c_ldd[1906] c_ldd[1907] c_ldd[1908] c_ldd[1909] c_ldd[1910] c_ldd[1911] c_ldd[1912] c_ldd[1913] c_ldd[1914] c_ldd[1915] c_ldd[1916] c_ldd[1917] c_ldd[1918] c_ldd[1919] c_ldd[1920] c_ldd[1921] c_ldd[1922] c_ldd[1923] c_ldd[1924] c_ldd[1925] c_ldd[1926] c_ldd[1927] c_ldd[1928] c_ldd[1929] c_ldd[1930] c_ldd[1931] c_ldd[1932] c_ldd[1933] c_ldd[1934] c_ldd[1935] c_ldd[1936] c_ldd[1937] c_ldd[1938] c_ldd[1939] c_ldd[1940] c_ldd[1941] c_ldd[1942] c_ldd[1943] c_ldd[1944] c_ldd[1945] c_ldd[1946] c_ldd[1947] c_ldd[1948] c_ldd[1949] c_ldd[1950] c_ldd[1951] c_ldd[1952] +0 49 +1 4.49503 10.9496 -9.51513 9.76683 -18.2757 5.06405 39.8529 0.114405 13.3216 0.134392 8.07812 236.479 0.110188 78.9295 0.193969 47.5315 178.577 1.65132 59.8012 1.7958 36.4171 188.149 1.6524 63.4702 2.14313 38.4147 658.786 0.886907 220.671 1.19001 132.84 353.335 1.01431 118.109 0.341942 1.19152 0.342292 39.5941 5107.23 2.37973 1704.64 0.821219 4.18914 0.816552 569.718 -3351.46 -30.9914 -1122.33 -10.8333 -33.7029 -10.4267 -377.565 3624.52 31.8319 1222.7 10.4135 41.2855 10.8783 417.427 3132.67 18588.6 4.37096 10.6474 -9.25251 9.49726 -17.7713 4.92428 38.7529 0.111247 12.9539 0.130682 7.85516 229.952 0.107147 76.751 0.188615 46.2196 173.648 1.60574 58.1507 1.74623 35.412 182.956 1.60679 61.7184 2.08398 37.3544 640.603 0.862428 214.58 1.15717 129.173 343.583 0.986318 114.85 0.332504 1.15863 0.332844 38.5013 4966.27 2.31405 1657.59 0.798553 4.07352 0.794015 553.993 -3258.96 -30.136 -1091.35 -10.5343 -32.7726 -10.1389 -367.144 3524.48 30.9534 1188.95 10.1261 40.146 10.578 405.906 3046.2 18075.5 4.51943 10.6538 -10.1605 9.64074 -17.0469 5.67958 40.284 0.214448 13.5432 0.307119 8.22367 223.86 0.212115 74.7829 0.253561 45.019 203.609 2.03963 67.9955 1.77758 41.5817 183.31 4.66792 61.8587 3.45837 38.3103 573.136 1.90355 191.523 1.31909 115.239 359.072 1.91149 120.718 0.664993 2.73751 0.691926 40.9172 4703.78 4.457 1571.35 1.49225 5.32787 1.47773 526.051 -4080.16 -40.8725 -1362.58 -13.7097 -35.6214 -13.4691 -455.876 3485.48 88.7564 1176.19 31.7132 65.7578 31.4138 401.989 3200.6 17785.8 4.39409 10.3583 -9.87872 9.37336 -16.5741 5.52206 39.1668 0.208501 13.1676 0.298601 7.99559 217.651 0.206232 72.7088 0.246529 43.7704 197.962 1.98306 66.1097 1.72828 40.4285 178.226 4.53846 60.1431 3.36245 37.2478 557.241 1.85075 186.212 1.2825 112.043 349.114 1.85848 117.37 0.64655 2.66159 0.672736 39.7824 4573.32 4.33339 1527.77 1.45087 5.18011 1.43674 511.461 -3967 -39.7389 -1324.79 -13.3294 -34.6335 -13.0956 -443.232 3388.81 86.2948 1143.57 30.8337 63.9341 30.5426 390.84 3111.83 17292.6 4.60187 10.9376 -8.98069 9.74094 -18.2912 4.81709 41.7766 0.192115 13.9403 0.150262 8.44855 235.997 0.0754332 78.7109 0.128212 47.3399 159.105 2.76723 53.161 1.72279 32.911 187.183 1.97007 62.594 2.19639 37.7061 660.009 1.92675 220.436 1.25478 132.585 379.255 1.74406 126.553 0.563025 1.36411 0.58104 42.2741 5092.03 1.6276 1698.32 0.52917 2.76639 0.549626 566.758 -2818.75 -49.0251 -941.818 -16.8877 -30.5214 -16.591 -315.413 3596.92 37.857 1202.81 13.1353 42.2061 12.8434 403.516 3442.94 19449.2 4.4763 10.6391 -8.73564 9.47514 -17.7921 4.68565 40.6366 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-1179.53 -0.054999 -0.235161 -0.88216 0.265243 1.10098 0.633122 -0.924342 -0.172719 -0.279918 -0.0808906 -0.0429833 -10.1318 -0.372312 -3.51482 -0.224124 -2.02018 37.3497 -0.157944 12.4081 1.34785 7.77322 9.10499 5.86673 3.06286 2.9218 1.35011 -79.4588 0.0972029 -27.6013 0.590689 -17.2325 -11.6879 -1.46078 -3.66174 -0.479915 -0.689969 -0.475485 -1.06095 -328.01 -8.07306 -112.369 -2.70297 -4.90981 -2.72181 -39.5349 -1185.43 2.11295 -394.477 1.84894 -30.6318 0.843571 -131.102 234.102 101.257 78.7037 37.7539 50.7937 34.1059 25.9767 -131.47 -1151.59 diff --git a/examples/PACKAGES/pod/Ta/sample_ld.txt b/examples/PACKAGES/pod/Ta/sample_ld.txt new file mode 100644 index 0000000000..8383773dba --- /dev/null +++ b/examples/PACKAGES/pod/Ta/sample_ld.txt @@ -0,0 +1,2 @@ +# Fix print output for fix ldprint +0.134391735306588 diff --git a/src/ML-POD/compute_pod_atom.cpp b/src/ML-POD/compute_pod_atom.cpp index 29a6dc060a..6cd544c0b5 100644 --- a/src/ML-POD/compute_pod_atom.cpp +++ b/src/ML-POD/compute_pod_atom.cpp @@ -216,8 +216,7 @@ double ComputePODAtom::memory_usage() return bytes; } - -void ComputePODAtom::lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtypes, +void ComputePODAtom::lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtypes, int *numneigh, double rcutsq, int gi) { nij = 0; diff --git a/src/ML-POD/compute_pod_atom.h b/src/ML-POD/compute_pod_atom.h index d5e3149345..85c7b69e1e 100644 --- a/src/ML-POD/compute_pod_atom.h +++ b/src/ML-POD/compute_pod_atom.h @@ -32,7 +32,7 @@ class ComputePODAtom : public Compute { void init_list(int, class NeighList *) override; void compute_peratom() override; double memory_usage() override; - void lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtype, int *numneigh, + void lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtype, int *numneigh, double rcutsq, int i); void map_element2type(int narg, char **arg, int nelements); diff --git a/src/ML-POD/compute_pod_global.cpp b/src/ML-POD/compute_pod_global.cpp index 9865cc9afc..330be8c020 100644 --- a/src/ML-POD/compute_pod_global.cpp +++ b/src/ML-POD/compute_pod_global.cpp @@ -217,7 +217,7 @@ double ComputePODGlobal::memory_usage() } -void ComputePODGlobal::lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtypes, +void ComputePODGlobal::lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtypes, int *numneigh, double rcutsq, int gi) { nij = 0; diff --git a/src/ML-POD/compute_pod_global.h b/src/ML-POD/compute_pod_global.h index 2b946b4765..f6753811bb 100644 --- a/src/ML-POD/compute_pod_global.h +++ b/src/ML-POD/compute_pod_global.h @@ -32,7 +32,7 @@ class ComputePODGlobal : public Compute { void init_list(int, class NeighList *) override; void compute_array() override; double memory_usage() override; - void lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtype, int *numneigh, + void lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtype, int *numneigh, double rcutsq, int i); void map_element2type(int narg, char **arg, int nelements); diff --git a/src/ML-POD/compute_pod_local.cpp b/src/ML-POD/compute_pod_local.cpp index 6e524ba4e1..2c5c43d472 100644 --- a/src/ML-POD/compute_pod_local.cpp +++ b/src/ML-POD/compute_pod_local.cpp @@ -214,7 +214,7 @@ double ComputePODLocal::memory_usage() } -void ComputePODLocal::lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtypes, +void ComputePODLocal::lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtypes, int *numneigh, double rcutsq, int gi) { nij = 0; diff --git a/src/ML-POD/compute_pod_local.h b/src/ML-POD/compute_pod_local.h index 706ffb72b3..93a7215c73 100644 --- a/src/ML-POD/compute_pod_local.h +++ b/src/ML-POD/compute_pod_local.h @@ -32,7 +32,7 @@ class ComputePODLocal : public Compute { void init_list(int, class NeighList *) override; void compute_array() override; double memory_usage() override; - void lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtype, int *numneigh, + void lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtype, int *numneigh, double rcutsq, int i); void map_element2type(int narg, char **arg, int nelements); diff --git a/src/ML-POD/compute_podd_atom.cpp b/src/ML-POD/compute_podd_atom.cpp index 96f6bdab05..617d2028da 100644 --- a/src/ML-POD/compute_podd_atom.cpp +++ b/src/ML-POD/compute_podd_atom.cpp @@ -213,7 +213,7 @@ double ComputePODDAtom::memory_usage() } -void ComputePODDAtom::lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtypes, +void ComputePODDAtom::lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtypes, int *numneigh, double rcutsq, int gi) { nij = 0; diff --git a/src/ML-POD/compute_podd_atom.h b/src/ML-POD/compute_podd_atom.h index 43635cbf62..5320ce836f 100644 --- a/src/ML-POD/compute_podd_atom.h +++ b/src/ML-POD/compute_podd_atom.h @@ -32,7 +32,7 @@ class ComputePODDAtom : public Compute { void init_list(int, class NeighList *) override; void compute_peratom() override; double memory_usage() override; - void lammpsNeighborList(double **x, int **firstneigh, int *atomid, int *atomtype, int *numneigh, + void lammpsNeighborList(double **x, int **firstneigh, tagint *atomid, int *atomtype, int *numneigh, double rcutsq, int i); void map_element2type(int narg, char **arg, int nelements);