Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology | |
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MP4/TZVP
5 | ||||||||||
4 | ||||||||||
3 | ||||||||||
2 | ||||||||||
1 | ||||||||||
0 | ||||||||||
1.88 | 1.89 | 1.90 | ||||||||
bond lengths (Å) |
Average bond length | Standard deviation |
---|---|
1.882 | 0.000 |
Species | Name | Bond Length (Å) | |
---|---|---|---|
Lowest value | MgCO3 | Magnesium Carbonate | 1.882 |
Highest value | MgCO3 | Magnesium Carbonate | 1.882 |
Species | Name | Bond Length (Å) | Atom1 index | Atom2 index |
---|---|---|---|---|
MgCO3 | Magnesium Carbonate | 1.882 | 3 | 4 |
1.882 | 3 | 5 |