annotate CADDSuite-1.6/data/QSAR/atomic_ionization_potentials.data @ 8:dbb480e39d95 draft

Uploaded
author marcel
date Sat, 15 Dec 2012 13:15:46 -0500
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
8
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
1 # atomic ionization potentials (neutral atom and +1 ion), CRC Handbook of Chemistry and Physics, 79th edition, 1998
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
2 13.59844 20.02
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
3 24.58741 54.41778
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
4 5.39172 75.64018
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
5 9.3227 18.21116
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
6 8.29803 25.15484
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
7 11.26030 24.38332
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
8 14.53414 29.6013
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
9 13.61806 35.11730
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
10 17.42282 34.97082
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
11 21.5646 40.96328
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
12 5.13908 47.2864
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
13 7.64624 15.03528
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
14 5.98577 18.82856
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
15 8.15169 16.34585
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
16 10.48669 19.7694
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
17 10.36001 23.3379
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
18 12.96764 23.814
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
19 15.75962 27.62967
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
20 4.34066 31.63
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
21 6.11316 11.87172
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
22 6.5615 12.79967
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
23 6.8281 13.5755
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
24 6.7463 14.66
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
25 6.7665 16.4857
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
26 7.43402 15.63999
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
27 7.9024 16.1878
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
28 7.8810 17.083
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
29 7.6398 18.16884
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
30 7.72638 20.29240
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
31 9.3942 17.96440
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
32 5.99930 20.5142
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
33 7.8994 15.93462
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
34 9.7886 18.633
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
35 9.75238 21.19
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
36 11.81381 21.8
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
37 13.99961 24.35985
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
38 4.17713 27.285
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
39 5.6949 11.03013
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
40 6.2171 12.24
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
41 6.63390 13.13
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
42 6.75885 14.32
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
43 7.09243 16.16
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
44 7.28 15.26
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
45 7.36050 16.76
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
46 7.45890 18.08
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
47 8.3369 19.43
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
48 7.5763 21.49
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
49 8.9938 16.90832
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
50 5.78636 18.8698
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
51 7.3439 14.63225
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
52 8.6084 16.53051
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
53 9.0096 18.6
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
54 10.45126 19.1313
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
55 12.1298 21.20979
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
56 3.89390 23.15745
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
57 5.21170 10.00390
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
58 5.770 11.060
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
59 5.5387 10.85
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
60 5.464 10.55
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
61 5.5250 10.73
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
62 5.58 10.9
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
63 5.6436 11.07
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
64 5.6704 11.241
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
65 6.1501 12.09
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
66 5.8638 11.52
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
67 5.9389 11.67
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
68 6.0215 11.80
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
69 6.1077 11.93
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
70 6.18431 12.05
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
71 6.25416 12.1761
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
72 5.4259 13.9
dbb480e39d95 Uploaded
marcel
parents:
diff changeset
73 6.82507 14.9