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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
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| semi-empirical | AM1 | 2659 |
|---|---|---|
| PM6 | 3077 | |
| composite | G2 | 3186 |
| G3 | 3186 | |
| G3B3 | 2935 | |
| G3MP2 | 3185 | |
| G4 | 2949 | |
| CBS-Q | 3186 | |
| molecular mechanics | DREIDING | 2903 |
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