diff --git a/example/log_sample_script.txt b/example/log_sample_script.txt index 1a593ed7..6fc258a0 100644 --- a/example/log_sample_script.txt +++ b/example/log_sample_script.txt @@ -1,121 +1,292 @@ -size of dWS (jmax 9 e2max 8 J12max 9 Nnmax 20): - dtri 4.46 MB dcgm0 1.11 MB d6j_int 4.46 MB d6j_lj 0.28 MB +size of dWS (jmax 9 lmax 40 e2max 8 Nnmax 20): + dtri 4.46 MB dcgm0 1.11 MB d6j_int 1.11 MB d6j_lj 0.28 MB d9j_lsj 1.76 MB dictHOB 0.44 MB -size of dWS (jmax 9 e2max 8 J12max 9 Nnmax 20): - dtri 4.46 MB dcgm0 1.11 MB d6j_int 4.46 MB d6j_lj 0.28 MB +size of dWS (jmax 9 lmax 40 e2max 8 Nnmax 20): + dtri 4.46 MB dcgm0 1.11 MB d6j_int 1.11 MB d6j_lj 0.28 MB d9j_lsj 1.76 MB dictHOB 0.44 MB -target: O16 Ref. => Z=8 N=8 E: -136.1336 = E1b 353.97 + E2b -490.10 ( -56.25 -358.95 -74.90) -EMP2 -33.44661 1b -0.000 pp -2.747 pn -27.662 nn -3.037 -EMP3 -2.71877 pp -2.836 hh -3.255 ph 3.373 -E_HF -136.13359 E_MBPT(3) = -172.2990 Eexp: -127.619 +target: O16 Ref. => Z=8 N=8 E: -132.9506 = E1b 363.70 + E2b -496.65 ( -55.16 -367.32 -74.18) +EMP2 -23.70628 1b -0.000 pp -1.437 pn -20.815 nn -1.454 +EMP3 0.37645 pp -0.111 hh -1.895 ph 2.383 +E_HF -132.95058 E_MBPT(3) = -156.2804 Eexp: -127.619 parameters in optional_parameters.jl will be used. step: s E0 ||Omega_1|| ||Omega_2|| ||Eta_1|| ||Eta_2|| Ncomm. nwritten - 0 0.000 -136.13359383 0.000000e+00 0.000000e+00 1.545377e-16 1.819642e+00 0 0 - 1 0.500 -161.95398842 7.726887e-17 9.098212e-01 1.790484e-02 8.880241e-01 8 0 - 2 1.000 -169.00392847 8.952418e-03 4.440121e-01 1.878743e-02 5.269968e-01 15 1 - 3 1.500 -171.55271847 9.393713e-03 2.634984e-01 1.677310e-02 3.391104e-01 21 2 - 4 2.000 -172.61610272 8.386548e-03 1.695552e-01 1.454594e-02 2.298204e-01 27 3 - 5 2.500 -173.10689355 1.556802e-02 2.838896e-01 1.252511e-02 1.615441e-01 34 3 - 6 3.000 -173.35065303 6.262555e-03 8.077207e-02 1.070578e-02 1.165864e-01 39 4 - 7 3.500 -173.47831475 1.158339e-02 1.389003e-01 9.059899e-03 8.580998e-02 44 4 - 8 4.000 -173.54781386 1.604860e-02 1.814693e-01 7.584989e-03 6.410602e-02 50 4 - 9 4.500 -173.58674948 1.975296e-02 2.130604e-01 6.285549e-03 4.844386e-02 56 4 - 10 5.000 -173.60903911 2.279433e-02 2.367472e-01 5.161444e-03 3.693570e-02 62 4 - 11 5.500 -173.62201296 2.526857e-02 2.546522e-01 4.205150e-03 2.835796e-02 68 4 - 12 6.000 -173.62965217 2.102575e-03 1.417898e-02 3.399579e-03 2.188572e-02 72 5 - 13 6.500 -173.63419707 3.801145e-03 2.511537e-02 2.732974e-03 1.696243e-02 76 5 - 14 7.000 -173.63692238 5.164902e-03 3.358265e-02 2.186786e-03 1.319054e-02 80 5 - 15 7.500 -173.63856686 6.254180e-03 4.015785e-02 1.742897e-03 1.028436e-02 84 5 - 16 8.000 -173.63956416 7.120423e-03 4.527585e-02 1.384569e-03 8.035086e-03 88 5 - 17 8.500 -173.64017129 7.806746e-03 4.926714e-02 1.096920e-03 6.288016e-03 93 5 - 18 9.000 -173.64054223 8.348807e-03 5.238445e-02 8.670717e-04 4.927180e-03 98 5 - 19 9.500 -173.64076943 8.775781e-03 5.482215e-02 6.841127e-04 3.864814e-03 103 5 - 20 10.000 -173.64090889 9.111336e-03 5.673029e-02 5.389383e-04 3.033978e-03 108 5 - 21 10.500 -173.64099464 9.374532e-03 5.822513e-02 4.240466e-04 2.383296e-03 113 5 - 22 11.000 -173.64104744 9.580635e-03 5.939699e-02 3.333166e-04 1.873131e-03 118 5 - 23 11.500 -173.64108000 9.741804e-03 6.031617e-02 2.617936e-04 1.472779e-03 123 5 - 24 12.000 -173.64110009 9.867690e-03 6.103749e-02 2.054925e-04 1.158379e-03 128 5 - 25 12.500 -173.64111249 9.965923e-03 6.160378e-02 1.612248e-04 9.113372e-04 133 5 - 26 13.000 -173.64112016 1.004252e-02 6.204850e-02 1.264506e-04 7.171330e-04 138 5 - 27 13.500 -173.64112490 1.010220e-02 6.239787e-02 9.915366e-05 5.644097e-04 143 5 - 28 14.000 -173.64112784 1.014868e-02 6.267239e-02 7.773791e-05 4.442719e-04 148 5 - 29 14.500 -173.64112965 1.018487e-02 6.288816e-02 6.094310e-05 3.497448e-04 153 5 - 30 15.000 -173.64113078 1.021304e-02 6.305778e-02 4.777595e-05 2.753545e-04 158 5 - 31 15.500 -173.64113147 1.023496e-02 6.319114e-02 3.745484e-05 2.168024e-04 163 5 - 32 16.000 -173.64113190 1.025202e-02 6.329601e-02 2.936547e-05 1.707108e-04 168 5 - 33 16.500 -173.64113217 1.026529e-02 6.337850e-02 2.302553e-05 1.344243e-04 173 5 - 34 17.000 -173.64113233 1.027562e-02 6.344338e-02 1.805659e-05 1.058548e-04 178 5 - 35 17.500 -173.64113244 1.028366e-02 6.349442e-02 1.416194e-05 8.335973e-05 183 5 - 36 18.000 -173.64113250 1.028991e-02 6.353457e-02 1.110903e-05 6.564660e-05 188 5 - 37 18.500 -173.64113254 1.029479e-02 6.356617e-02 8.715645e-06 5.169830e-05 193 5 - 38 19.000 -173.64113256 1.029858e-02 6.359103e-02 6.839040e-06 4.071427e-05 198 5 - 39 19.500 -173.64113258 1.030153e-02 6.361060e-02 5.367398e-06 3.206433e-05 203 5 - 40 20.000 -173.64113259 1.030384e-02 6.362600e-02 4.213138e-06 2.525234e-05 208 5 - 41 20.500 -173.64113259 1.030563e-02 6.363812e-02 3.307652e-06 1.988768e-05 213 5 - 42 21.000 -173.64113260 1.030703e-02 6.364766e-02 2.597197e-06 1.566278e-05 218 5 - 43 21.500 -173.64113260 1.030812e-02 6.365517e-02 2.039667e-06 1.233546e-05 223 5 - 44 22.000 -173.64113260 1.030897e-02 6.366108e-02 1.602066e-06 9.715002e-06 228 5 - 45 22.500 -173.64113260 1.030963e-02 6.366573e-02 1.258537e-06 7.651234e-06 233 5 - 46 23.000 -173.64113260 1.031015e-02 6.366939e-02 9.888121e-07 6.025882e-06 238 5 - 47 23.500 -173.64113260 1.031056e-02 6.367228e-02 7.769993e-07 4.745807e-06 243 5 - 48 24.000 -173.64113260 1.031087e-02 6.367455e-02 6.106382e-07 3.737659e-06 248 5 - 49 24.500 -173.64113260 1.031112e-02 6.367633e-02 4.799555e-07 2.943671e-06 253 5 - 50 25.000 -173.64113260 1.031131e-02 6.367774e-02 3.772844e-07 2.318348e-06 258 5 - 51 25.500 -173.64113260 1.031146e-02 6.367885e-02 2.966095e-07 1.825862e-06 263 5 - 52 26.000 -173.64113260 1.031158e-02 6.367972e-02 2.332099e-07 1.437993e-06 268 5 - 53 26.500 -173.64113260 1.031168e-02 6.368041e-02 1.833799e-07 1.132519e-06 273 5 - 54 27.000 -173.64113260 1.031175e-02 6.368095e-02 1.442106e-07 8.919361e-07 278 5 + 0 0.000 -132.95057781 0.000000e+00 0.000000e+00 8.338154e-17 1.410292e+00 0 0 + 1 0.500 -150.64837609 4.169077e-17 7.051459e-01 4.457285e-02 6.465559e-01 10 0 + 2 1.000 -154.78704838 2.228643e-02 3.232779e-01 5.387093e-02 3.441643e-01 18 1 + 3 1.500 -156.02709507 2.693546e-02 1.720822e-01 5.200791e-02 1.968159e-01 25 2 + 4 2.000 -156.46234611 5.291574e-02 2.697514e-01 4.609815e-02 1.192463e-01 34 2 + 5 2.500 -156.63786066 2.304908e-02 5.962317e-02 3.915110e-02 7.603387e-02 40 3 + 6 3.000 -156.71754528 4.261375e-02 9.740456e-02 3.246552e-02 5.082054e-02 47 3 + 7 3.500 -156.75734646 5.883469e-02 1.223106e-01 2.655233e-02 3.554179e-02 55 3 + 8 4.000 -156.77877263 7.209319e-02 1.393224e-01 2.156017e-02 2.604640e-02 63 3 + 9 4.500 -156.79104484 8.284970e-02 1.513341e-01 1.745834e-02 2.007233e-02 71 3 + 10 5.000 -156.79848127 9.154892e-02 1.600942e-01 1.414576e-02 1.629448e-02 79 3 + 11 5.500 -156.80324373 9.858457e-02 1.666945e-01 1.150104e-02 1.388250e-02 87 3 + 12 6.000 -156.80646858 1.042894e-01 1.718341e-01 9.405852e-03 1.230019e-02 95 3 + 13 6.500 -156.80877527 1.089366e-01 1.759706e-01 7.754598e-03 1.120726e-02 104 3 + 14 7.000 -156.81051145 1.127468e-01 1.794075e-01 6.457349e-03 1.039706e-02 113 3 + 15 7.500 -156.81187735 1.158958e-01 1.823489e-01 5.439592e-03 9.749738e-03 122 3 + 16 8.000 -156.81299135 1.185223e-01 1.849332e-01 4.640660e-03 9.198211e-03 131 3 + 17 8.500 -156.81392512 1.207286e-01 1.872546e-01 4.015938e-03 8.705218e-03 139 3 + 18 9.000 -156.81472443 1.226094e-01 1.893775e-01 3.520493e-03 8.251996e-03 147 3 + 19 9.500 -156.81541866 1.242303e-01 1.913467e-01 3.124629e-03 7.827798e-03 155 3 + 20 10.000 -156.81602782 1.256424e-01 1.931932e-01 2.805005e-03 7.426899e-03 163 3 + 21 10.500 -156.81656612 1.268858e-01 1.949382e-01 2.543557e-03 7.046196e-03 171 3 + 22 11.000 -156.81704414 1.279916e-01 1.965967e-01 2.326485e-03 6.683924e-03 179 3 + 23 11.500 -156.81747005 1.289842e-01 1.981790e-01 2.143354e-03 6.338987e-03 187 3 + 24 12.000 -156.81785041 1.298828e-01 1.996926e-01 1.986340e-03 6.010600e-03 195 3 + 25 12.500 -156.81819065 1.307022e-01 2.011427e-01 1.849605e-03 5.698119e-03 203 3 + 26 13.000 -156.81849533 1.314544e-01 2.025332e-01 1.728808e-03 5.400952e-03 211 3 + 27 13.500 -156.81876840 1.321487e-01 2.038672e-01 1.620718e-03 5.118518e-03 219 3 + 28 14.000 -156.81901328 1.327926e-01 2.051470e-01 1.522924e-03 4.850238e-03 227 3 + 29 14.500 -156.81923296 1.333922e-01 2.063745e-01 1.433620e-03 4.595530e-03 235 3 + 30 15.000 -156.81943009 1.339523e-01 2.075515e-01 1.351441e-03 4.353810e-03 243 3 + 31 15.500 -156.81960704 1.344770e-01 2.086796e-01 1.275347e-03 4.124497e-03 251 3 + 32 16.000 -156.81976590 1.349696e-01 2.097602e-01 1.204533e-03 3.907021e-03 259 3 + 33 16.500 -156.81990854 1.354330e-01 2.107947e-01 1.138373e-03 3.700822e-03 267 3 + 34 17.000 -156.82003317 5.691865e-04 1.850411e-03 1.074658e-03 3.506997e-03 272 4 + 35 17.500 -156.82014499 1.106509e-03 3.603905e-03 1.015349e-03 3.323020e-03 277 4 + 36 18.000 -156.82024531 1.614168e-03 5.265407e-03 9.598947e-04 3.148469e-03 282 4 + 37 18.500 -156.82033533 2.094090e-03 6.839628e-03 9.078782e-04 2.982918e-03 287 4 + 38 19.000 -156.82041609 2.547997e-03 8.331069e-03 8.589724e-04 2.825941e-03 292 4 + 39 19.500 -156.82048854 2.977444e-03 9.744018e-03 8.129099e-04 2.677124e-03 297 4 + 40 20.000 -156.82055356 3.383857e-03 1.108256e-02 7.694672e-04 2.536064e-03 302 4 + 41 20.500 -156.82061188 3.768545e-03 1.235056e-02 7.284533e-04 2.402376e-03 307 4 + 42 21.000 -156.82066421 4.132725e-03 1.355172e-02 6.897020e-04 2.275686e-03 312 4 + 43 21.500 -156.82071117 4.477530e-03 1.468954e-02 6.530664e-04 2.155638e-03 317 4 + 44 22.000 -156.82075329 4.804017e-03 1.576733e-02 6.184151e-04 2.041891e-03 323 4 + 45 22.500 -156.82079108 5.113180e-03 1.678825e-02 5.856293e-04 1.934120e-03 329 4 + 46 23.000 -156.82082498 5.405952e-03 1.775529e-02 5.546002e-04 1.832017e-03 335 4 + 47 23.500 -156.82085540 5.683211e-03 1.867127e-02 5.252279e-04 1.735286e-03 341 4 + 48 24.000 -156.82088269 5.945786e-03 1.953889e-02 4.974198e-04 1.643648e-03 347 4 + 49 24.500 -156.82090717 6.194459e-03 2.036069e-02 4.710897e-04 1.556836e-03 353 4 + 50 25.000 -156.82092913 6.429969e-03 2.113909e-02 4.461569e-04 1.474599e-03 359 4 + 51 25.500 -156.82094883 6.653014e-03 2.187636e-02 4.225460e-04 1.396697e-03 365 4 + 52 26.000 -156.82096651 6.864257e-03 2.257469e-02 4.001858e-04 1.322902e-03 371 4 + 53 26.500 -156.82098237 7.064321e-03 2.323613e-02 3.790095e-04 1.253000e-03 377 4 + 54 27.000 -156.82099659 7.253799e-03 2.386261e-02 3.589540e-04 1.186785e-03 383 4 + 55 27.500 -156.82100935 7.433251e-03 2.445599e-02 3.399597e-04 1.124063e-03 389 4 + 56 28.000 -156.82102080 7.603207e-03 2.501800e-02 3.219703e-04 1.064652e-03 395 4 + 57 28.500 -156.82103107 7.764171e-03 2.555032e-02 3.049325e-04 1.008377e-03 401 4 + 58 29.000 -156.82104028 7.916617e-03 2.605449e-02 2.887961e-04 9.550725e-04 407 4 + 59 29.500 -156.82104854 8.060996e-03 2.653201e-02 2.735132e-04 9.045825e-04 413 4 + 60 30.000 -156.82105595 8.197734e-03 2.698429e-02 2.590387e-04 8.567587e-04 419 4 + 61 30.500 -156.82106260 8.327237e-03 2.741266e-02 2.453300e-04 8.114605e-04 425 4 + 62 31.000 -156.82106857 8.449887e-03 2.781838e-02 2.323465e-04 7.685550e-04 431 4 + 63 31.500 -156.82107392 8.566046e-03 2.820265e-02 2.200499e-04 7.279160e-04 437 4 + 64 32.000 -156.82107872 8.676057e-03 2.856660e-02 2.084039e-04 6.894239e-04 443 4 + 65 32.500 -156.82108302 8.780246e-03 2.891131e-02 1.973741e-04 6.529656e-04 449 4 + 66 33.000 -156.82108688 8.878922e-03 2.923778e-02 1.869279e-04 6.184337e-04 455 4 + 67 33.500 -156.82109035 8.972374e-03 2.954699e-02 1.770345e-04 5.857267e-04 461 4 + 68 34.000 -156.82109345 9.060881e-03 2.983985e-02 1.676646e-04 5.547481e-04 467 4 + 69 34.500 -156.82109624 9.144704e-03 3.011722e-02 1.587905e-04 5.254069e-04 473 4 + 70 35.000 -156.82109874 9.224090e-03 3.037991e-02 1.503861e-04 4.976166e-04 479 4 + 71 35.500 -156.82110098 9.299275e-03 3.062872e-02 1.424264e-04 4.712953e-04 485 4 + 72 36.000 -156.82110300 9.370480e-03 3.086436e-02 1.348880e-04 4.463654e-04 491 4 + 73 36.500 -156.82110480 9.437916e-03 3.108754e-02 1.277486e-04 4.227536e-04 497 4 + 74 37.000 -156.82110642 9.501784e-03 3.129891e-02 1.209870e-04 4.003901e-04 503 4 + 75 37.500 -156.82110787 9.562271e-03 3.149910e-02 1.145833e-04 3.792090e-04 509 4 + 76 38.000 -156.82110917 9.619556e-03 3.168870e-02 1.085185e-04 3.591479e-04 515 4 + 77 38.500 -156.82111034 9.673809e-03 3.186827e-02 1.027747e-04 3.401476e-04 521 4 + 78 39.000 -156.82111139 9.725191e-03 3.203834e-02 9.733496e-05 3.221521e-04 527 4 + 79 39.500 -156.82111233 9.773854e-03 3.219941e-02 9.218310e-05 3.051083e-04 533 4 + 80 40.000 -156.82111317 9.819940e-03 3.235197e-02 8.730392e-05 2.889658e-04 539 4 + 81 40.500 -156.82111393 9.863588e-03 3.249645e-02 8.268300e-05 2.736771e-04 545 4 + 82 41.000 -156.82111461 9.904925e-03 3.263328e-02 7.830665e-05 2.591970e-04 551 4 + 83 41.500 -156.82111522 9.944074e-03 3.276288e-02 7.416194e-05 2.454828e-04 557 4 + 84 42.000 -156.82111576 9.981151e-03 3.288562e-02 7.023662e-05 2.324940e-04 563 4 + 85 42.500 -156.82111625 1.001627e-02 3.300186e-02 6.651905e-05 2.201922e-04 569 4 + 86 43.000 -156.82111669 1.004952e-02 3.311196e-02 6.299826e-05 2.085412e-04 575 4 + 87 43.500 -156.82111708 1.008102e-02 3.321622e-02 5.966383e-05 1.975066e-04 581 4 + 88 44.000 -156.82111744 1.011085e-02 3.331498e-02 5.650588e-05 1.870556e-04 587 4 + 89 44.500 -156.82111775 1.013910e-02 3.340850e-02 5.351509e-05 1.771575e-04 593 4 + 90 45.000 -156.82111804 1.016585e-02 3.349708e-02 5.068259e-05 1.677831e-04 599 4 + 91 45.500 -156.82111829 1.019119e-02 3.358097e-02 4.800002e-05 1.589046e-04 605 4 + 92 46.000 -156.82111852 1.021519e-02 3.366042e-02 4.545944e-05 1.504959e-04 611 4 + 93 46.500 -156.82111873 1.023792e-02 3.373567e-02 4.305333e-05 1.425320e-04 617 4 + 94 47.000 -156.82111891 1.025944e-02 3.380693e-02 4.077457e-05 1.349895e-04 623 4 + 95 47.500 -156.82111907 1.027983e-02 3.387442e-02 3.861643e-05 1.278461e-04 629 4 + 96 48.000 -156.82111922 1.029913e-02 3.393835e-02 3.657252e-05 1.210806e-04 635 4 + 97 48.500 -156.82111936 1.031742e-02 3.399889e-02 3.463679e-05 1.146731e-04 641 4 + 98 49.000 -156.82111947 1.033473e-02 3.405622e-02 3.280352e-05 1.086046e-04 647 4 + 99 49.500 -156.82111958 1.035113e-02 3.411052e-02 3.106728e-05 1.028572e-04 653 4 + 100 50.000 -156.82111968 1.036667e-02 3.416195e-02 2.942294e-05 9.741393e-05 659 4 + 101 50.500 -156.82111976 1.038138e-02 3.421066e-02 2.786563e-05 9.225868e-05 665 4 + 102 51.000 -156.82111984 1.039531e-02 3.425678e-02 2.639075e-05 8.737623e-05 671 4 + 103 51.500 -156.82111991 1.040850e-02 3.430047e-02 2.499393e-05 8.275213e-05 677 4 + 104 52.000 -156.82111997 1.042100e-02 3.434185e-02 2.367105e-05 7.837272e-05 683 4 + 105 52.500 -156.82112003 1.043283e-02 3.438103e-02 2.241818e-05 7.422506e-05 689 4 + 106 53.000 -156.82112008 1.044404e-02 3.441814e-02 2.123163e-05 7.029688e-05 695 4 + 107 53.500 -156.82112012 1.045465e-02 3.445329e-02 2.010788e-05 6.657657e-05 701 4 + 108 54.000 -156.82112016 1.046471e-02 3.448658e-02 1.904361e-05 6.305314e-05 707 4 + 109 54.500 -156.82112020 1.047423e-02 3.451811e-02 1.803567e-05 5.971616e-05 713 4 + 110 55.000 -156.82112023 1.048324e-02 3.454796e-02 1.708108e-05 5.655577e-05 719 4 + 111 55.500 -156.82112026 1.049178e-02 3.457624e-02 1.617701e-05 5.356263e-05 725 4 + 112 56.000 -156.82112028 1.049987e-02 3.460302e-02 1.532079e-05 5.072788e-05 731 4 + 113 56.500 -156.82112031 1.050753e-02 3.462839e-02 1.450990e-05 4.804315e-05 737 4 + 114 57.000 -156.82112033 1.051479e-02 3.465241e-02 1.374192e-05 4.550050e-05 743 4 + 115 57.500 -156.82112035 1.052166e-02 3.467516e-02 1.301459e-05 4.309241e-05 749 4 + 116 58.000 -156.82112036 1.052816e-02 3.469670e-02 1.232575e-05 4.081176e-05 755 4 + 117 58.500 -156.82112038 1.053433e-02 3.471711e-02 1.167338e-05 3.865181e-05 761 4 + 118 59.000 -156.82112039 1.054016e-02 3.473643e-02 1.105553e-05 3.660617e-05 767 4 + 119 59.500 -156.82112041 1.054569e-02 3.475474e-02 1.047038e-05 3.466878e-05 773 4 + 120 60.000 -156.82112042 1.055092e-02 3.477207e-02 9.916210e-06 3.283393e-05 779 4 + 121 60.500 -156.82112043 1.055588e-02 3.478849e-02 9.391367e-06 3.109619e-05 785 4 + 122 61.000 -156.82112043 1.056058e-02 3.480403e-02 8.894303e-06 2.945041e-05 791 4 + 123 61.500 -156.82112044 1.056502e-02 3.481876e-02 8.423548e-06 2.789173e-05 797 4 + 124 62.000 -156.82112045 1.056923e-02 3.483271e-02 7.977709e-06 2.641554e-05 803 4 + 125 62.500 -156.82112046 1.057322e-02 3.484591e-02 7.555467e-06 2.501748e-05 809 4 + 126 63.000 -156.82112046 1.057700e-02 3.485842e-02 7.155573e-06 2.369341e-05 815 4 + 127 63.500 -156.82112047 1.058058e-02 3.487027e-02 6.776845e-06 2.243942e-05 821 4 + 128 64.000 -156.82112047 1.058397e-02 3.488149e-02 6.418163e-06 2.125179e-05 827 4 + 129 64.500 -156.82112048 1.058717e-02 3.489211e-02 6.078464e-06 2.012701e-05 833 4 + 130 65.000 -156.82112048 1.059021e-02 3.490218e-02 5.756745e-06 1.906177e-05 839 4 + 131 65.500 -156.82112048 1.059309e-02 3.491171e-02 5.452054e-06 1.805290e-05 845 4 + 132 66.000 -156.82112049 1.059582e-02 3.492073e-02 5.163490e-06 1.709743e-05 851 4 + 133 66.500 -156.82112049 1.059840e-02 3.492928e-02 4.890199e-06 1.619253e-05 857 4 + 134 67.000 -156.82112049 1.060084e-02 3.493738e-02 4.631372e-06 1.533551e-05 863 4 + 135 67.500 -156.82112049 1.060316e-02 3.494505e-02 4.386245e-06 1.452386e-05 869 4 + 136 68.000 -156.82112049 1.060535e-02 3.495231e-02 4.154091e-06 1.375516e-05 875 4 + 137 68.500 -156.82112050 1.060743e-02 3.495919e-02 3.934225e-06 1.302715e-05 881 4 + 138 69.000 -156.82112050 1.060940e-02 3.496570e-02 3.725996e-06 1.233767e-05 887 4 + 139 69.500 -156.82112050 1.061126e-02 3.497187e-02 3.528788e-06 1.168467e-05 893 4 + 140 70.000 -156.82112050 1.061302e-02 3.497771e-02 3.342018e-06 1.106624e-05 899 4 + 141 70.500 -156.82112050 1.061469e-02 3.498324e-02 3.165133e-06 1.048054e-05 905 4 + 142 71.000 -156.82112050 1.061628e-02 3.498848e-02 2.997610e-06 9.925842e-06 911 4 + 143 71.500 -156.82112050 1.061777e-02 3.499345e-02 2.838954e-06 9.400498e-06 917 4 + 144 72.000 -156.82112050 1.061919e-02 3.499815e-02 2.688695e-06 8.902960e-06 923 4 + 145 72.500 -156.82112050 1.062054e-02 3.500260e-02 2.546389e-06 8.431754e-06 929 4 + 146 73.000 -156.82112051 1.062181e-02 3.500681e-02 2.411615e-06 7.985487e-06 935 4 + 147 73.500 -156.82112051 1.062302e-02 3.501081e-02 2.283974e-06 7.562840e-06 941 4 + 148 74.000 -156.82112051 1.062416e-02 3.501459e-02 2.163089e-06 7.162562e-06 947 4 + 149 74.500 -156.82112051 1.062524e-02 3.501817e-02 2.048602e-06 6.783469e-06 953 4 + 150 75.000 -156.82112051 1.062626e-02 3.502156e-02 1.940174e-06 6.424440e-06 959 4 + 151 75.500 -156.82112051 1.062723e-02 3.502477e-02 1.837486e-06 6.084413e-06 965 4 + 152 76.000 -156.82112051 1.062815e-02 3.502781e-02 1.740232e-06 5.762383e-06 971 4 + 153 76.500 -156.82112051 1.062902e-02 3.503070e-02 1.648126e-06 5.457397e-06 977 4 + 154 77.000 -156.82112051 1.062985e-02 3.503342e-02 1.560895e-06 5.168553e-06 983 4 + 155 77.500 -156.82112051 1.063063e-02 3.503601e-02 1.478281e-06 4.894996e-06 989 4 + 156 78.000 -156.82112051 1.063137e-02 3.503846e-02 1.400039e-06 4.635918e-06 995 4 + 157 78.500 -156.82112051 1.063207e-02 3.504077e-02 1.325938e-06 4.390552e-06 1001 4 + 158 79.000 -156.82112051 1.063273e-02 3.504297e-02 1.255760e-06 4.158172e-06 1007 4 + 159 79.500 -156.82112051 1.063336e-02 3.504505e-02 1.189295e-06 3.938092e-06 1013 4 + 160 80.000 -156.82112051 1.063395e-02 3.504702e-02 1.126349e-06 3.729660e-06 1019 4 + 161 80.500 -156.82112051 1.063452e-02 3.504888e-02 1.066734e-06 3.532259e-06 1025 4 + 162 81.000 -156.82112051 1.063505e-02 3.505065e-02 1.010275e-06 3.345306e-06 1031 4 + 163 81.500 -156.82112051 1.063555e-02 3.505232e-02 9.568032e-07 3.168249e-06 1037 4 + 164 82.000 -156.82112051 1.063603e-02 3.505390e-02 9.061620e-07 3.000562e-06 1043 4 + 165 82.500 -156.82112051 1.063648e-02 3.505540e-02 8.582011e-07 2.841750e-06 1049 4 + 166 83.000 -156.82112051 1.063691e-02 3.505683e-02 8.127787e-07 2.691344e-06 1055 4 + 167 83.500 -156.82112051 1.063732e-02 3.505817e-02 7.697603e-07 2.548899e-06 1061 4 + 168 84.000 -156.82112051 1.063771e-02 3.505945e-02 7.290189e-07 2.413992e-06 1067 4 + 169 84.500 -156.82112051 1.063807e-02 3.506065e-02 6.904337e-07 2.286226e-06 1073 4 + 170 85.000 -156.82112051 1.063841e-02 3.506180e-02 6.538908e-07 2.165222e-06 1079 4 + 171 85.500 -156.82112051 1.063874e-02 3.506288e-02 6.192820e-07 2.050623e-06 1085 4 + 172 86.000 -156.82112051 1.063905e-02 3.506390e-02 5.865050e-07 1.942089e-06 1091 4 + 173 86.500 -156.82112051 1.063934e-02 3.506487e-02 5.554627e-07 1.839299e-06 1097 4 + 174 87.000 -156.82112051 1.063962e-02 3.506579e-02 5.260635e-07 1.741950e-06 1103 4 + 175 87.500 -156.82112051 1.063989e-02 3.506667e-02 4.982203e-07 1.649753e-06 1109 4 + 176 88.000 -156.82112051 1.064013e-02 3.506749e-02 4.718507e-07 1.562436e-06 1115 4 + 177 88.500 -156.82112051 1.064037e-02 3.506827e-02 4.468768e-07 1.479741e-06 1121 4 + 178 89.000 -156.82112051 1.064059e-02 3.506901e-02 4.232248e-07 1.401422e-06 1127 4 + 179 89.500 -156.82112051 1.064081e-02 3.506971e-02 4.008245e-07 1.327248e-06 1133 4 + 180 90.000 -156.82112051 1.064101e-02 3.507038e-02 3.796099e-07 1.257000e-06 1139 4 + 181 90.500 -156.82112051 1.064120e-02 3.507100e-02 3.595181e-07 1.190471e-06 1145 4 + 182 91.000 -156.82112051 1.064138e-02 3.507160e-02 3.404897e-07 1.127462e-06 1151 4 + 183 91.500 -156.82112051 1.064155e-02 3.507216e-02 3.224685e-07 1.067789e-06 1157 4 + 184 92.000 -156.82112051 1.064171e-02 3.507270e-02 3.054010e-07 1.011273e-06 1163 4 + 185 92.500 -156.82112051 1.064186e-02 3.507320e-02 2.892369e-07 9.577492e-07 1169 4 + 186 93.000 -156.82112051 1.064200e-02 3.507368e-02 2.739283e-07 9.070580e-07 1175 4 Starting VS-IMSRG flow step: s E0 ||Omega_1|| ||Omega_2|| ||Eta_1|| ||Eta_2|| Ncomm. nwritten - 0 27.000 -173.64113260 0.000000e+00 0.000000e+00 3.175962e-01 7.600518e+00 278 6 - 1 27.500 -173.64113260 1.587981e-01 3.800259e+00 1.901823e-01 3.509875e+00 289 6 - 2 28.000 -173.64113260 9.509116e-02 1.754938e+00 2.480042e-01 1.876165e+00 297 7 - 3 28.500 -173.64113260 1.240021e-01 9.380824e-01 2.086771e-01 1.062829e+00 304 8 - 4 29.000 -173.64113260 1.043385e-01 5.314146e-01 1.545414e-01 6.268972e-01 310 9 - 5 29.500 -173.64113260 7.727071e-02 3.134486e-01 1.082431e-01 3.820843e-01 316 10 - 6 30.000 -173.64113260 5.412154e-02 1.910422e-01 7.369384e-02 2.392149e-01 321 11 - 7 30.500 -173.64113260 9.096677e-02 3.101614e-01 4.939673e-02 1.530251e-01 328 11 - 8 31.000 -173.64113260 2.469837e-02 7.651256e-02 3.281676e-02 9.955931e-02 333 12 - 9 31.500 -173.64113260 4.110579e-02 1.261587e-01 2.168864e-02 6.564024e-02 338 12 - 10 32.000 -173.64113260 5.194782e-02 1.587186e-01 1.429020e-02 4.373873e-02 343 12 - 11 32.500 -173.64113260 5.908935e-02 1.802482e-01 9.398808e-03 2.940048e-02 348 12 - 12 33.000 -173.64113260 6.378419e-02 1.945764e-01 6.175645e-03 1.991021e-02 353 12 - 13 33.500 -173.64113260 6.686687e-02 2.041624e-01 4.055927e-03 1.357208e-02 358 12 - 14 34.000 -173.64113260 6.888949e-02 2.106047e-01 2.663452e-03 9.306656e-03 363 12 - 15 34.500 -173.64113260 7.021600e-02 2.149513e-01 1.749242e-03 6.416703e-03 368 12 - 16 35.000 -173.64113260 7.108575e-02 2.178947e-01 1.149159e-03 4.446629e-03 373 12 - 17 35.500 -173.64113260 7.165596e-02 2.198944e-01 7.552551e-04 3.095975e-03 378 12 - 18 36.000 -173.64113260 7.202977e-02 2.212574e-01 4.966339e-04 2.165038e-03 383 12 - 19 36.500 -173.64113260 7.227483e-02 2.221891e-01 3.267741e-04 1.520164e-03 388 12 - 20 37.000 -173.64113260 7.243550e-02 2.228280e-01 2.151607e-04 1.071344e-03 393 12 - 21 37.500 -173.64113260 7.254084e-02 2.232672e-01 1.417801e-04 7.576000e-04 398 12 - 22 38.000 -173.64113260 7.260991e-02 2.235700e-01 9.350542e-05 5.373850e-04 403 12 - 23 38.500 -173.64113260 7.265520e-02 2.237794e-01 6.172482e-05 3.822384e-04 408 12 - 24 39.000 -173.64113260 7.268490e-02 2.239244e-01 4.078664e-05 2.725605e-04 413 12 - 25 39.500 -173.64113260 7.270438e-02 2.240252e-01 2.698026e-05 1.947858e-04 418 12 - 26 40.000 -173.64113260 7.271715e-02 2.240954e-01 1.786825e-05 1.394806e-04 423 12 - 27 40.500 -173.64113260 7.272552e-02 2.241444e-01 1.184857e-05 1.000550e-04 428 12 - 28 41.000 -173.64113260 7.273101e-02 2.241787e-01 7.867594e-06 7.188699e-05 433 12 - 29 41.500 -173.64113260 7.273461e-02 2.242028e-01 5.231871e-06 5.172205e-05 438 12 - 30 42.000 -173.64113260 7.273696e-02 2.242197e-01 3.484678e-06 3.726079e-05 443 12 - 31 42.500 -173.64113260 7.273851e-02 2.242315e-01 2.324954e-06 2.687356e-05 448 12 - 32 43.000 -173.64113260 7.273952e-02 2.242399e-01 1.554073e-06 1.940211e-05 453 12 - 33 43.500 -173.64113260 7.274018e-02 2.242458e-01 1.040872e-06 1.402115e-05 458 12 - 34 44.000 -173.64113260 7.274061e-02 2.242500e-01 6.986480e-07 1.014137e-05 463 12 - 35 44.500 -173.64113260 7.274089e-02 2.242530e-01 4.700279e-07 7.341086e-06 468 12 - 36 45.000 -173.64113260 7.274107e-02 2.242551e-01 3.170029e-07 5.318038e-06 473 12 - 37 45.500 -173.64113260 7.274119e-02 2.242566e-01 2.143620e-07 3.855237e-06 478 12 - 38 46.000 -173.64113260 7.274127e-02 2.242577e-01 1.453602e-07 2.796687e-06 483 12 - 39 46.500 -173.64113260 7.274132e-02 2.242584e-01 9.886011e-08 2.030100e-06 488 12 - 40 47.000 -173.64113260 7.274135e-02 2.242590e-01 6.744252e-08 1.474558e-06 493 12 - 41 47.500 -173.64113260 7.274137e-02 2.242594e-01 4.615669e-08 1.071690e-06 498 12 - 42 48.000 -173.64113260 7.274138e-02 2.242596e-01 3.169309e-08 7.793521e-07 503 12 + 0 93.000 -156.82112051 0.000000e+00 0.000000e+00 3.229158e-01 6.378179e+00 1175 5 + 1 93.500 -156.82112051 1.614579e-01 3.189090e+00 9.227151e-02 2.761175e+00 1185 5 + 2 94.000 -156.82112051 4.613575e-02 1.380588e+00 1.389716e-01 1.441046e+00 1193 6 + 3 94.500 -156.82112051 6.948582e-02 7.205232e-01 1.184896e-01 8.269515e-01 1201 7 + 4 95.000 -156.82112051 5.924480e-02 4.134758e-01 8.893113e-02 5.161785e-01 1208 8 + 5 95.500 -156.82112051 4.446556e-02 2.580892e-01 6.482493e-02 3.480325e-01 1215 9 + 6 96.000 -156.82112051 3.241246e-02 1.740163e-01 4.762813e-02 2.502454e-01 1221 10 + 7 96.500 -156.82112051 5.621124e-02 2.977482e-01 3.579587e-02 1.888736e-01 1229 10 + 8 97.000 -156.82112051 1.789794e-02 9.443679e-02 2.761892e-02 1.475082e-01 1235 11 + 9 97.500 -156.82112051 3.169891e-02 1.677967e-01 2.182843e-02 1.179198e-01 1241 11 + 10 98.000 -156.82112051 4.259421e-02 2.259722e-01 1.759313e-02 9.577239e-02 1247 11 + 11 98.500 -156.82112051 5.136303e-02 2.728047e-01 1.439169e-02 7.863840e-02 1254 11 + 12 99.000 -156.82112051 7.195846e-03 3.931920e-02 1.189991e-02 6.506699e-02 1259 12 + 13 99.500 -156.82112051 1.314460e-02 7.181908e-02 9.914422e-03 5.413659e-02 1265 12 + 14 100.000 -156.82112051 1.809915e-02 9.881703e-02 8.303855e-03 4.522856e-02 1271 12 + 15 100.500 -156.82112051 2.224708e-02 1.213313e-01 6.980349e-03 3.790600e-02 1277 12 + 16 101.000 -156.82112051 2.573216e-02 1.401637e-01 5.882715e-03 3.184809e-02 1283 12 + 17 101.500 -156.82112051 2.866758e-02 1.559548e-01 4.966578e-03 2.681195e-02 1289 12 + 18 102.000 -156.82112051 3.114431e-02 1.692216e-01 4.198543e-03 2.260932e-02 1295 12 + 19 102.500 -156.82112051 3.323662e-02 1.803857e-01 3.552696e-03 1.909163e-02 1301 12 + 20 103.000 -156.82112051 3.500574e-02 1.897928e-01 3.008432e-03 1.614001e-02 1307 12 + 21 103.500 -156.82112051 3.650263e-02 1.977283e-01 2.549069e-03 1.365835e-02 1313 12 + 22 104.000 -156.82112051 3.776984e-02 2.044287e-01 2.160925e-03 1.156828e-02 1319 12 + 23 104.500 -156.82112051 3.884307e-02 2.100906e-01 1.832674e-03 9.805459e-03 1325 12 + 24 105.000 -156.82112051 3.975235e-02 2.148784e-01 1.554884e-03 8.316818e-03 1331 12 + 25 105.500 -156.82112051 4.052298e-02 2.189293e-01 1.319662e-03 7.058360e-03 1337 12 + 26 106.000 -156.82112051 4.117629e-02 2.223586e-01 1.120388e-03 5.993494e-03 1343 12 + 27 106.500 -156.82112051 4.173029e-02 2.252629e-01 9.514930e-04 5.091694e-03 1349 12 + 28 107.000 -156.82112051 4.220019e-02 2.277237e-01 8.082886e-04 4.327428e-03 1356 12 + 29 107.500 -156.82112051 4.259886e-02 2.298095e-01 6.868218e-04 3.679298e-03 1363 12 + 30 108.000 -156.82112051 4.293716e-02 2.315779e-01 5.837569e-04 3.129333e-03 1370 12 + 31 108.500 -156.82112051 4.322431e-02 2.330777e-01 4.962771e-04 2.662418e-03 1377 12 + 32 109.000 -156.82112051 4.346809e-02 2.343501e-01 4.220026e-04 2.265824e-03 1384 12 + 33 109.500 -156.82112051 4.367510e-02 2.354298e-01 3.589212e-04 1.928813e-03 1391 12 + 34 110.000 -156.82112051 4.385091e-02 2.363463e-01 3.053310e-04 1.642322e-03 1398 12 + 35 110.500 -156.82112051 4.400025e-02 2.371243e-01 2.597919e-04 1.398690e-03 1405 12 + 36 111.000 -156.82112051 4.412714e-02 2.377850e-01 2.210844e-04 1.191437e-03 1412 12 + 37 111.500 -156.82112051 4.423496e-02 2.383462e-01 1.881759e-04 1.015080e-03 1419 12 + 38 112.000 -156.82112051 4.432660e-02 2.388229e-01 1.601912e-04 8.649718e-04 1426 12 + 39 112.500 -156.82112051 4.440450e-02 2.392279e-01 1.363885e-04 7.371735e-04 1433 12 + 40 113.000 -156.82112051 4.447072e-02 2.395721e-01 1.161388e-04 6.283445e-04 1440 12 + 41 113.500 -156.82112051 4.452704e-02 2.398646e-01 9.890843e-05 5.356499e-04 1447 12 + 42 114.000 -156.82112051 4.457493e-02 2.401133e-01 8.424462e-05 4.566827e-04 1454 12 + 43 114.500 -156.82112051 4.461566e-02 2.403247e-01 7.176295e-05 3.893980e-04 1461 12 + 44 115.000 -156.82112051 4.465031e-02 2.405045e-01 6.113702e-05 3.320584e-04 1468 12 + 45 115.500 -156.82112051 4.467979e-02 2.406573e-01 5.208959e-05 2.831867e-04 1475 12 + 46 116.000 -156.82112051 4.470487e-02 2.407874e-01 4.438509e-05 2.415268e-04 1482 12 + 47 116.500 -156.82112051 4.472622e-02 2.408980e-01 3.782334e-05 2.060101e-04 1489 12 + 48 117.000 -156.82112051 4.474438e-02 2.409921e-01 3.223416e-05 1.757273e-04 1496 12 + 49 117.500 -156.82112051 4.475984e-02 2.410721e-01 2.747285e-05 1.499045e-04 1503 12 + 50 118.000 -156.82112051 4.477300e-02 2.411402e-01 2.341636e-05 1.278827e-04 1510 12 + 51 118.500 -156.82112051 4.478421e-02 2.411982e-01 1.996000e-05 1.091008e-04 1517 12 + 52 119.000 -156.82112051 4.479374e-02 2.412476e-01 1.701471e-05 9.308090e-05 1524 12 + 53 119.500 -156.82112051 4.480186e-02 2.412895e-01 1.450471e-05 7.941587e-05 1531 12 + 54 120.000 -156.82112051 4.480878e-02 2.413253e-01 1.236549e-05 6.775881e-05 1538 12 + 55 120.500 -156.82112051 4.481466e-02 2.413557e-01 1.054214e-05 5.781407e-05 1545 12 + 56 121.000 -156.82112051 4.481968e-02 2.413816e-01 8.987909e-06 4.932969e-05 1552 12 + 57 121.500 -156.82112051 4.482395e-02 2.414037e-01 7.662995e-06 4.209089e-05 1559 12 + 58 122.000 -156.82112051 4.482758e-02 2.414224e-01 6.533495e-06 3.591454e-05 1566 12 + 59 122.500 -156.82112051 4.483068e-02 2.414384e-01 5.570534e-06 3.064452e-05 1573 12 + 60 123.000 -156.82112051 4.483331e-02 2.414520e-01 4.749516e-06 2.614769e-05 1580 12 + 61 123.500 -156.82112051 4.483556e-02 2.414636e-01 4.049488e-06 2.231051e-05 1587 12 + 62 124.000 -156.82112051 4.483747e-02 2.414734e-01 3.452595e-06 1.903615e-05 1594 12 + 63 124.500 -156.82112051 4.483910e-02 2.414818e-01 2.943626e-06 1.624200e-05 1601 12 + 64 125.000 -156.82112051 4.484048e-02 2.414890e-01 2.509617e-06 1.385762e-05 1608 12 + 65 125.500 -156.82112051 4.484166e-02 2.414951e-01 2.139518e-06 1.182289e-05 1615 12 + 66 126.000 -156.82112051 4.484267e-02 2.415002e-01 1.823913e-06 1.008654e-05 1622 12 + 67 126.500 -156.82112051 4.484352e-02 2.415046e-01 1.554774e-06 8.604821e-06 1629 12 + 68 127.000 -156.82112051 4.484425e-02 2.415084e-01 1.325260e-06 7.340408e-06 1636 12 + 69 127.500 -156.82112051 4.484487e-02 2.415116e-01 1.129537e-06 6.261450e-06 1643 12 + 70 128.000 -156.82112051 4.484540e-02 2.415143e-01 9.626320e-07 5.340772e-06 1650 12 + 71 128.500 -156.82112051 4.484585e-02 2.415166e-01 8.203041e-07 4.555181e-06 1657 12 + 72 129.000 -156.82112051 4.484623e-02 2.415185e-01 6.989383e-07 3.884890e-06 1664 12 + 73 129.500 -156.82112051 4.484655e-02 2.415202e-01 5.954516e-07 3.313011e-06 1671 12 + 74 130.000 -156.82112051 4.484683e-02 2.415216e-01 5.072152e-07 2.825132e-06 1678 12 + 75 130.500 -156.82112051 4.484706e-02 2.415228e-01 4.319873e-07 2.408955e-06 1685 12 + 76 131.000 -156.82112051 4.484726e-02 2.415238e-01 3.678562e-07 2.053984e-06 1692 12 + 77 131.500 -156.82112051 4.484743e-02 2.415247e-01 3.131915e-07 1.751261e-06 1699 12 + 78 132.000 -156.82112051 4.484757e-02 2.415254e-01 2.666027e-07 1.493143e-06 1706 12 + 79 132.500 -156.82112051 4.484770e-02 2.415260e-01 2.269041e-07 1.273107e-06 1713 12 + 80 133.000 -156.82112051 4.484780e-02 2.415266e-01 1.930844e-07 1.085586e-06 1720 12 + 81 133.500 -156.82112051 4.484789e-02 2.415270e-01 1.642813e-07 9.258295e-07 1727 12 Operator:Rp2 - HF point proton radius 2.080327 charge radius 2.239613 => HF+PT 2.283615 -IMSRG point proton radius 2.148956 charge radius 2.303502 - Mg24 Z,N=(12,12) c(8,8) v(4,4) mdim: 28503 ( 4.45 ) J [0.0, 2.0, 2.0, 3.0, 4.0, 4.0, 5.0, 6.0, 4.0, 1.0] -En. -111.771 -110.292 -109.311 -108.112 -107.397 -106.231 -104.331 -103.164 -103.048 -102.762 -Ex. 0.000 1.480 2.461 3.659 4.375 5.540 7.440 8.607 8.723 9.009 + HF point proton radius 2.049501 charge radius 2.211009 => HF+PT 2.229791 +IMSRG point proton radius 2.099186 charge radius 2.257141 + Mg24 Z,N=(12,12) c(8,8) v(4,4) mdim: 28503 ( 4.45 ) J [0.0, 2.0, 2.0, 3.0, 4.0, 4.0, 5.0, 1.0, 6.0, 2.0] +En. -109.065 -107.717 -106.056 -104.800 -104.748 -103.238 -101.177 -100.704 -100.138 -100.119 +Ex. 0.000 1.348 3.010 4.265 4.317 5.828 7.889 8.361 8.928 8.946