FOD optimization of a carbon atom. The geometry is taken from CMU compare directory.
Carbon atom | ||||
1509 | Perfect | |||
No. SCFs | E | F | E | F |
1 | -37.949706436039 | 5.99E-02 | -37.949732226438 | 5.98E-02 |
2 | -37.951523634177 | 3.67E-02 | -37.951545400556 | 3.66E-02 |
3 | -37.953166878574 | 1.92E-02 | -37.953185688536 | 1.92E-02 |
4 | -37.952174153207 | 5.03E-02 | -37.952198031727 | 5.01E-02 |
5 | -37.953433742657 | 1.83E-02 | -37.9534517531 | 1.82E-02 |
6 | -37.953495888744 | 1.91E-02 | -37.9535137612 | 1.90E-02 |
7 | -37.95349845351 | 1.94E-02 | -37.953516414401 | 1.94E-02 |
8 | -37.953498459442 | 1.95E-02 | -37.953516429632 | 1.94E-02 |
9 | -37.954207630253 | 1.59E-02 | -37.954223549658 | 1.59E-02 |
10 | -37.955259057871 | 1.08E-02 | -37.95527049341 | 1.07E-02 |
11 | -37.955828717475 | 1.72E-02 | -37.955825922823 | 1.74E-02 |
12 | -37.95593219311 | 1.04E-02 | -37.955934523638 | 1.03E-02 |
13 | -37.955932362556 | 1.10E-02 | -37.955934717736 | 1.10E-02 |
14 | -37.955932314093 | 1.10E-02 | -37.955934670806 | 1.10E-02 |
15 | -37.956252689149 | 4.53E-03 | -37.956254325451 | 4.53E-03 |
16 | -37.956288133902 | 5.66E-03 | -37.956290690082 | 5.64E-03 |
17 | -37.956351258298 | 3.51E-03 | -37.956353195149 | 3.50E-03 |
18 | -37.956351267283 | 3.58E-03 | -37.956353203689 | 3.58E-03 |
19 | -37.956351265048 | 3.58E-03 | -37.956353201762 | 3.58E-03 |
20 | -37.956366673007 | 4.65E-03 | -37.956368986247 | 4.64E-03 |
21 | -37.956400295036 | 1.29E-03 | -37.956402648846 | 1.29E-03 |
22 | -37.956400898511 | 1.39E-03 | -37.956403245993 | 1.39E-03 |
23 | -37.956400895213 | 1.40E-03 | -37.956403242629 | 1.40E-03 |
24 | -37.956434517876 | 1.06E-03 | -37.956436823601 | 1.06E-03 |
25 | -37.956407820609 | 3.26E-03 | -37.956410392267 | 3.25E-03 |
26 | -37.956439921224 | 1.48E-03 | -37.956442256897 | 1.48E-03 |
27 | -37.956439921449 | 1.48E-03 | -37.956442257116 | 1.48E-03 |
28 | -37.956467787528 | 7.90E-04 | -37.956470051929 | 7.92E-04 |
29 | -37.956435837502 | 2.10E-03 | -37.956437111921 | 2.11E-03 |
30 | -37.956470558742 | 8.76E-04 | ||
31 | -37.956470559151 | 8.81E-04 | ||
32 | -37.956444303438 | 3.73E-03 | ||
33 | -37.956475052643 | 6.71E-04 | ||
34 | -37.956475073838 | 7.26E-04 | ||
35 | -37.956427356192 | 3.49E-03 | ||
36 | -37.956476917088 | 2.04E-04 | ||
37 | -37.956476932412 | 1.78E-04 | ||
38 | -37.956455255467 | 2.16E-03 | ||
39 | -37.956477647927 | 2.67E-04 | ||
40 | -37.956477651292 | 2.80E-04 | ||
41 | -37.956424435324 | 4.08E-03 | ||
42 | -37.956478625017 | 3.99E-04 | ||
43 | -37.956478629683 | 4.23E-04 | ||
44 | -37.95647520061 | 3.16E-03 | ||
45 | -37.956481257244 | 9.77E-04 | ||
46 | -37.956481317597 | 1.10E-03 | ||
47 | -37.956499815545 | 2.45E-03 | ||
48 | -37.956544602322 | 5.12E-03 | ||
49 | -37.956544398907 | 5.05E-03 | ||
50 | -37.956544501472 | 5.08E-03 |