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|
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BaSH: Barium monohydrosulfide
Electronic State: X2A'
Reference: A. Janczyk and L. M.
Ziurys,
J. Chem. Phys. 119, 10702 (2003).
| Parameter |
BaSH |
BaSD |
| |
|
|
| A |
290 342(49) |
149 030(48) |
| B |
2413.2528(36) |
2356.247(13) |
| C |
2390.6535(33) |
2316.145(12) |
| DN |
9.4901(15) x 10-4 |
9.4043(39) x 10-4 |
| DNK |
0.14232(82) |
0.13176(37) |
| d1 |
-9.20(16) x 10-6 |
-1.670(55) x 10-5 |
| d2 |
- |
-3.253(31) x 10-6 |
| HNK |
1.31(79) x 10-7 |
1.17(35) x 10-7 |
| HKN |
-1.08(62) x 10 -4 |
1.34(24) x 10 -5 |
| h3 |
--- |
4.7(3.0) x 10-12 |
| LNK |
1.08(58) x 10-8 |
|
| LKKN |
9.3(1.3) x 10-6 |
|
| PKN |
-1.52(11) x 10-7 |
|
| PNKK |
-3.3(1.1) x 10-10 |
|
| PKN |
-1.52(11) x 10-7 |
|
| eaa |
308.7(9.9) |
176(20) |
ebb |
45.09(18) |
44.17(17) |
ecc |
66.98(15) |
65.56(12) |
(eab + eba)/2 |
-7.806(83) |
-10.6(4.5) |
DNS |
2.4(1.0) x 10-9 |
--- |
D0 (amu Å2) |
0.239 04(52) |
0.3225(16) |
| rms |
0.032 |
0.027 |
|
