Results for the 2017 edition of the Annual DFT Popularity Poll: 9. NMR shieldings, NMR couplings
| functional | love (++) | like (+) | neutral (0) | dislike (-) | hate (--) | #votes | points | average | |||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | B3LYP-D | 2 | 3.1 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 3 | 4.7 % | 3 | 0.05 |
| 2 | wB97X-V | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 3 | 0.05 |
| 3 | B97M-V | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 3 | 0.05 |
| 4 | wB97M-V | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 3 | 0.05 |
| 5 | PBE-D | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 3 | 0.05 |
| 6 | B3LYP | 2 | 3.1 % | 1 | 1.6 % | 1 | 1.6 % | 0 | 0.0 % | 2 | 3.1 % | 6 | 9.4 % | 1 | 0.02 |
| 7 | DSD-PBEP86 | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 8 | LC-PBE | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 9 | M06-2X | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 10 | PBE0 | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 3 | 4.7 % | 0 | 0.00 |
| 11 | PWPB95-D3 | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 12 | S12g | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 13 | SAOP | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.00 |
| 14 | OLYP | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | -2 | -0.03 |
| 15 | S12h | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | -2 | -0.03 |
| 16 | SSB-D | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | -2 | -0.03 |
| 17 | B3PW91 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 18 | B97-D | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 19 | BHandH | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 20 | BP86 | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | -3 | -0.05 |
| 21 | CAM-B3LYP | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | -3 | -0.05 |
| 22 | DSD-BLYP | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 23 | HSE | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 24 | LB94 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 25 | LC-wPBE | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 26 | M06 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 27 | M06-L | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 28 | MVS | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 29 | optB88-vdW | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 30 | PW6B95 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 31 | PW91 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 32 | revPBE | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 33 | revTPSS | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 34 | revTPSS-D | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 35 | RPA | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 36 | RPBE | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 37 | SCAN | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 38 | TPSSh | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 39 | PBE-QIDH | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 1 | 1.6 % | -3 | -0.05 |
| 40 | PBE | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 0 | 0.0 % | 2 | 3.1 % | 5 | 7.8 % | -5 | -0.08 |
| 41 | wB97X-D | 0 | 0.0 % | 0 | 0.0 % | 3 | 4.7 % | 0 | 0.0 % | 2 | 3.1 % | 5 | 7.8 % | -6 | -0.09 |
| 42 | BLYP | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 2 | 3.1 % | -6 | -0.09 |
| 43 | MN12L | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 2 | 3.1 % | -6 | -0.09 |
| 44 | MN15 | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 2 | 3.1 % | 2 | 3.1 % | -6 | -0.09 |
| 45 | LDA | 0 | 0.0 % | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 2 | 3.1 % | 3 | 4.7 % | -7 | -0.11 |
| 46 | B2PLYP | 0 | 0.0 % | 0 | 0.0 % | 1 | 1.6 % | 0 | 0.0 % | 3 | 4.7 % | 4 | 6.2 % | -9 | -0.14 |
| total number of participants: 64 | |||||||||||||||