|
Bond*
|
ρBCP(r) |
εBCP(r) |
δBCP(r) |
HBCP(r) |
|H(r)|/ρ(r) |
[Bk(CO3)4]4-
|
Bk–O(1) |
0.45 |
0.04 |
0.29 |
-143.9 |
323.3 |
|
Bk–O(2) |
0.45 |
0.03 |
0.29 |
-148.3 |
330.4 |
[Bk(CO3)3(OH)2]4-
|
Bk–O(1) |
0.4 |
0.04 |
0.26 |
-100 |
246.6 |
|
Bk–O(2) |
0.38 |
0.02 |
0.24 |
-78.4 |
207.7 |
|
Bk–OH(1) |
0.56 |
0.13 |
0.39 |
-301.8 |
536.9 |
|
Bk–OH(2) |
0.57 |
0.09 |
0.4 |
-279 |
488.7 |