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the poll
rules
latest edition
news-item
Blog entry Nature Chemistry
functionals
list
results
references
reviews/perspectives
organizers
Marcel Swart
Matthias Bickelhaupt
Miquel Duran
platform
We are using FillOut for our poll

Results for the 2024 edition of the Annual DFT Popularity Poll: Primera Divisió

  functional like   neutral   hate   blanc   none   #votes   points average
1 wB97X-D 67 65.7 % 14 13.7 % 4 3.9 % 5 4.9 % 90 88.2 % 12 11.8 % 211 2.07
2 PBE 54 52.9 % 20 19.6 % 12 11.8 % 5 4.9 % 91 89.2 % 11 10.8 % 170 1.67
3 PBE0 50 49.0 % 27 26.5 % 7 6.9 % 9 8.8 % 93 91.2 % 9 8.8 % 170 1.67
4 PBE-D 41 40.2 % 35 34.3 % 5 4.9 % 9 8.8 % 90 88.2 % 12 11.8 % 153 1.50
5 wB97X-V 41 40.2 % 27 26.5 % 1 1.0 % 20 19.6 % 89 87.3 % 13 12.7 % 149 1.46
6 wB97M-V 40 39.2 % 28 27.5 % 4 3.9 % 18 17.6 % 90 88.2 % 12 11.8 % 144 1.41
7 B3LYP-D 37 36.3 % 40 39.2 % 11 10.8 % 7 6.9 % 95 93.1 % 7 6.9 % 140 1.37
8 r2SCAN-3c 36 35.3 % 30 29.4 % 6 5.9 % 19 18.6 % 91 89.2 % 11 10.8 % 132 1.29
9 CAM-B3LYP 29 28.4 % 43 42.2 % 7 6.9 % 11 10.8 % 90 88.2 % 12 11.8 % 123 1.21
10 B97-D 25 24.5 % 44 43.1 % 2 2.0 % 21 20.6 % 92 90.2 % 10 9.8 % 117 1.15
11 B3LYP 34 33.3 % 36 35.3 % 25 24.5 % 2 2.0 % 97 95.1 % 5 4.9 % 113 1.11
12 r2SCAN-D4 30 29.4 % 30 29.4 % 8 7.8 % 21 20.6 % 89 87.3 % 13 12.7 % 112 1.10
13 TPSSh 30 29.4 % 31 30.4 % 11 10.8 % 19 18.6 % 91 89.2 % 11 10.8 % 110 1.08
14 M06-2X 37 36.3 % 21 20.6 % 26 25.5 % 10 9.8 % 94 92.2 % 8 7.8 % 106 1.04
15 BP86 18 17.6 % 44 43.1 % 10 9.8 % 19 18.6 % 91 89.2 % 11 10.8 % 88 0.86
16 HSE 20 19.6 % 33 32.4 % 11 10.8 % 25 24.5 % 89 87.3 % 13 12.7 % 82 0.80
17 PBEsol 17 16.7 % 39 38.2 % 8 7.8 % 24 23.5 % 88 86.3 % 14 13.7 % 82 0.80
18 SCAN 18 17.6 % 37 36.3 % 12 11.8 % 22 21.6 % 89 87.3 % 13 12.7 % 79 0.77
19 revPBE 13 12.7 % 45 44.1 % 5 4.9 % 24 23.5 % 87 85.3 % 15 14.7 % 79 0.77
20 LDA 14 13.7 % 25 24.5 % 33 32.4 % 17 16.7 % 89 87.3 % 13 12.7 % 34 0.33
total number of participants: 102