Table 1:
PES of CS-He: first
components in cm-1.
Distance (a0) |
V0 |
V1 |
V2 |
V3 |
V4 |
V5 |
V6 |
V7 |
3.5 |
25372.92 |
16802.61 |
44663.45 |
33809.44 |
36333.56 |
30357.23 |
25869.85 |
19732.80 |
4.0 |
12677.30 |
11240.08 |
24265.20 |
18209.81 |
17075.54 |
12827.29 |
9738.87 |
6895.29 |
4.5 |
5726.94 |
6046.74 |
11688.57 |
8852.93 |
7698.15 |
5382.99 |
3707.64 |
2404.21 |
5.0 |
2421.83 |
2949.39 |
5265.47 |
4049.15 |
3354.76 |
2229.49 |
1419.29 |
843.64 |
5.5 |
961.00 |
1351.09 |
2259.45 |
1771.73 |
1420.24 |
909.88 |
544.67 |
299.91 |
6.0 |
349.85 |
587.92 |
927.96 |
746.66 |
585.66 |
365.80 |
209.15 |
108.43 |
6.5 |
108.16 |
242.80 |
362.92 |
303.24 |
235.31 |
144.82 |
80.22 |
39.85 |
7.0 |
19.61 |
93.84 |
132.58 |
117.97 |
91.86 |
56.36 |
30.65 |
14.80 |
7.5 |
-8.64 |
32.58 |
42.87 |
43.20 |
34.56 |
21.46 |
11.60 |
5.50 |
8.0 |
-14.74 |
8.88 |
10.06 |
14.23 |
12.28 |
7.90 |
4.31 |
2.01 |
8.5 |
-13.66 |
0.54 |
-0.69 |
3.63 |
3.92 |
2.74 |
1.54 |
0.71 |
9.0 |
-10.88 |
-1.86 |
-3.38 |
0.10 |
0.95 |
0.84 |
0.51 |
0.24 |
9.5 |
-8.19 |
-2.16 |
-3.42 |
-0.84 |
-0.01 |
0.18 |
0.14 |
0.08 |
10.0 |
-6.06 |
-1.83 |
-2.77 |
-0.91 |
-0.25 |
-0.03 |
0.02 |
0.02 |
10.5 |
-4.47 |
-1.41 |
-2.08 |
-0.75 |
-0.26 |
-0.07 |
-0.01 |
0.01 |
11.0 |
-3.32 |
-1.04 |
-1.52 |
-0.56 |
-0.20 |
-0.06 |
-0.02 |
0.00 |
11.5 |
-2.49 |
-0.76 |
-1.10 |
-0.40 |
-0.14 |
-0.04 |
-0.01 |
0.00 |
12.0 |
-1.89 |
-0.55 |
-0.80 |
-0.28 |
-0.10 |
-0.03 |
-0.01 |
0.00 |
12.5 |
-1.45 |
-0.40 |
-0.58 |
-0.20 |
-0.07 |
-0.02 |
0.00 |
0.00 |
13.0 |
-1.13 |
-0.30 |
-0.43 |
-0.14 |
-0.05 |
-0.01 |
0.00 |
0.00 |
Source LaTeX |
All tables |
In the text