GWT LATTICE DFT — UNIFORM RADIAL GRID
======================================================================
Started: 2026-03-21 21:55:04
Grid: N=1000, dr=0.0300, r_max=30.0

   Z Sym   IE_obs    IE_eV     err  iter
------------------------------------------
   1   H   13.598    6.132  -54.9%    11
   2  He   24.587   20.583  -16.3%    15
   3  Li    5.392    2.583  -52.1%    10
   4  Be    9.323    6.494  -30.3%    20
   5   B    8.298    1.867  -77.5%    19
   6   C   11.260    3.464  -69.2%    20
   7   N   14.534    4.700  -67.7%    21
   8   O   13.618    7.360  -46.0%    22
   9   F   17.423    8.172  -53.1%    23
  10  Ne   21.565   17.969  -16.7%    24
  11  Na    5.139    4.072  -20.8%    21
  12  Mg    7.646    6.981   -8.7%    22
  13  Al    5.986    1.267  -78.8%    17
  14  Si    8.152    2.566  -68.5%    20
  15   P   10.487    3.716  -64.6%    21
  16   S   10.360    5.515  -46.8%    23
  17  Cl   12.968    6.516  -49.8%    24
  18  Ar   15.760   11.536  -26.8%    24
  19   K    4.341    4.030   -7.2%    23
  20  Ca    6.113    5.857   -4.2%    23
  21  Sc    6.561    0.105  -98.4%    80
  22  Ti    6.828    0.423  -93.8%    21
  23   V    6.746    0.742  -89.0%    22
  24  Cr    6.767    1.296  -80.8%    23
  25  Mn    7.434    2.054  -72.4%    24
  26  Fe    7.902    3.815  -51.7%    24
  27  Co    7.881    4.155  -47.3%    25
  28  Ni    7.640    4.556  -40.4%    25
  29  Cu    7.726    4.880  -36.8%    26
  30  Zn    9.394    5.334  -43.2%    26
  31  Ga    5.999    1.338  -77.7%    22
  32  Ge    7.900    2.585  -67.3%    24
  33  As    9.815    3.721  -62.1%    25
  34  Se    9.752    5.209  -46.6%    25
  35  Br   11.814    6.238  -47.2%    26
  36  Kr   14.000    9.521  -32.0%    27
  46  Pd    8.337    5.735  -31.2%    27
  47  Ag    7.576    6.458  -14.8%    28
  48  Cd    8.994    7.278  -19.1%    28
  54  Xe   12.130    8.211  -32.3%    27
  71  Lu    5.426    0.302  -94.4%    24
  79  Au    9.226    6.960  -24.6%    29
  80  Hg   10.438    7.849  -24.8%    29
  82  Pb    7.417    3.217  -56.6%    27
  86  Rn   10.749    8.667  -19.4%    29

Atoms: 45/45
Mean |error|: 48.1%
Median: 47.2%
Under 5%: 1/45
Under 10%: 3/45
Under 20%: 8/45
Time: 1071.1s

Completed: 2026-03-21 22:12:55
