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|
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MnCl: Manganese
monochloride
Electronic
State: X7S+
Reference: D. T.
Halfen and L. M. Ziurys, J. Chem. Phys. 122, 054309
(2005).
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|
Mn35Cl
|
|
| Parameter |
v = 0
|
v = 1
|
v = 2
|
| B |
4722.07137(18)
|
4697.8527(30)
|
4673.7122(30)
|
| D |
0.003 164 475(42) |
0.003 163 45(57)
|
0.003 165 24(56)
|
| g |
11.2658(71)
|
10.947(15)
|
10.834(15)
|
| gD |
-2.73(13) x 10-5
|
|
|
| l |
1113.10(72)
|
1076.9(7.2)
|
1067.7(15)
|
| lD |
-0.003 255(56)
|
-0.003 491(61)
|
-0.003 659(61)
|
| lH |
-8.9(1.4) x 10-8
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|
|
bF
|
397.71(62) |
374.3(4.3)
|
375.9(4.3)
|
| bFD |
4.87(18) x 10-4
|
7.53(46) x 10-4 |
6.50(43) x 10-4
|
| c |
32.35(99) |
94.1(6.6)
|
77.3(6.5)
|
| rms |
0.211
|
0.243
|
0.238
|
| Be |
4734.148(32)
|
|
|
| ae |
24.180(23)
|
|
|
| we |
386.30(6)
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|
|
Mn37Cl
|
|
| Parameter
|
v = 0 |
v = 1 |
| B |
4566.3922(16) |
4543.3677(30)
|
| D |
0.002 959 73(27)
|
0.002 959 95(56)
|
| g |
10.649(12)
|
10.578(17)
|
| l |
1031.7(4.1)
|
1073.2(8.4)
|
| lD |
-0.003 681(50)
|
-0.003 381(67)
|
| bF |
337.8(2.9)
|
368.7(4.7)
|
| bFD |
6.44(35) x 10-4
|
6.46(51) x 10-4 |
| c |
94.2(9.3)
|
114.0(6.6)
|
| rms |
0.256
|
0.207
|
| Be |
4577.904(32)
|
|
| ae |
23.024(23)
|
|
| we |
379.82(1)
|
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|
