USPEX中使用的goodBonds表,主要用于硬度计算etc.:
Z |
Element |
goodBonds |
Z |
Element |
goodBonds |
Z |
Element |
goodBonds |
1 |
H |
0.20 |
35 |
Br |
0.10 |
69 |
Tm |
0.20 |
2 |
He |
0.05 |
36 |
Kr |
0.05 |
70 |
Yb |
0.20 |
3 |
Li |
0.10 |
37 |
Rb |
0.05 |
71 |
Lu |
0.20 |
4 |
Be |
0.20 |
38 |
Sr |
0.10 |
72 |
Hf |
0.30 |
5 |
B |
0.30 |
39 |
Y |
0.20 |
73 |
Ta |
0.40 |
6 |
C |
0.50 |
40 |
Zr |
0.30 |
74 |
W |
0.30 |
7 |
N |
0.50 |
41 |
Nb |
0.35 |
75 |
Re |
0.30 |
8 |
O |
0.30 |
42 |
Mo |
0.30 |
76 |
Os |
0.30 |
9 |
F |
0.10 |
43 |
Tc |
0.30 |
77 |
Ir |
0.30 |
10 |
Ne |
0.05 |
44 |
Ru |
0.30 |
78 |
Pt |
0.30 |
11 |
Na |
0.05 |
45 |
Rh |
0.30 |
79 |
Au |
0.05 |
12 |
Mg |
0.10 |
46 |
Pd |
0.30 |
80 |
Hg |
0.10 |
13 |
Al |
0.20 |
47 |
Ag |
0.05 |
81 |
Tl |
0.20 |
14 |
Si |
0.30 |
48 |
Cd |
0.10 |
82 |
Pb |
0.30 |
15 |
P |
0.30 |
49 |
In |
0.20 |
83 |
Bi |
0.20 |
16 |
S |
0.20 |
50 |
Sn |
0.30 |
84 |
Po |
0.20 |
17 |
Cl |
0.10 |
51 |
Sb |
0.20 |
85 |
At |
0.10 |
18 |
Ar |
0.05 |
52 |
Te |
0.20 |
86 |
Rn |
0.05 |
19 |
K |
0.05 |
53 |
I |
0.10 |
87 |
Fr |
0.05 |
20 |
Ca |
0.10 |
54 |
Xe |
0.05 |
88 |
Ra |
0.10 |
21 |
Sc |
0.20 |
55 |
Cs |
0.05 |
89 |
Ac |
0.20 |
22 |
Ti |
0.30 |
56 |
Ba |
0.10 |
90 |
Th |
0.30 |
23 |
V |
0.30 |
57 |
La |
0.20 |
91 |
Pa |
0.30 |
24 |
Cr |
0.25 |
58 |
Ce |
0.30 |
92 |
U |
0.30 |
25 |
Mn |
0.30 |
59 |
Pr |
0.20 |
93 |
Np |
0.30 |
26 |
Fe |
0.25 |
60 |
Nd |
0.20 |
94 |
Pu |
0.30 |
27 |
Co |
0.25 |
61 |
Pm |
0.20 |
95 |
Am |
0.30 |
28 |
Ni |
0.15 |
62 |
Sm |
0.20 |
96 |
Cm |
0.30 |
29 |
Cu |
0.10 |
63 |
Eu |
0.20 |
97 |
Bk |
0.30 |
30 |
Zn |
0.10 |
64 |
Gd |
0.20 |
98 |
Cf |
0.30 |
31 |
Ga |
0.25 |
65 |
Tb |
0.20 |
99 |
Es |
0.30 |
32 |
Ge |
0.50 |
66 |
Dy |
0.20 |
100 |
FM |
0.30 |
33 |
As |
0.35 |
67 |
Ho |
0.20 |
101 |
Md |
0.30 |
34 |
Se |
0.20 |
68 |
Er |
0.20 |
102 |
No |
0.30 |