system na1 no ns SG V1 dV1 dSh dTv da db dc dalp dbet dgam dr phi dev str # # # str Ao3 % % % % % % deg deg deg mAo deg mAo median 1.4 3.1 3.1 -0.0 0.6 1.0 0.0 -0.5 -0.0 8 3.1 47 mean 1.2 4.4 4.5 0.4 -0.2 1.4 0.0 -0.8 0.0 28 4.7 50 standard dev 1.8 4.8 4.6 5.9 5.6 4.3 0.7 2.9 0.6 44 5.1 25 lower decile -1.4 1.0 1.2 -3.0 -5.8 -2.8 -0.2 -3.5 -0.3 2 0.8 23 upper decile 3.2 7.5 8.4 5.2 5.2 5.5 0.3 1.5 0.3 93 10.7 80 min -3.0 0.0 0.4 -21.5 -22.0 -13.7 -3.2 -13.8 -1.6 1 0.1 7 max 6.1 21.2 21.3 20.9 9.9 14.9 3.2 5.1 3.6 224 24.7 149 ------------------------------------------------------------------------------------------------------------------ anthracene 24 1 2 P21/c 9.15 2.2 1.2 1.2 0.6 1.7 -0.4 0.1 -1.0 -0.1 2 1.9 23 anthraquinone 24 1 2 P21/c 9.37 2.8 1.9 2.0 -1.5 3.7 1.0 -0.3 1.0 0.4 3 9.1 34 benzene 12 1 2 Pbca 9.25 2.3 0.5 0.8 1.2 0.2 1.0 -0.0 -0.0 0.0 5 0.9 7 benzeneF6 12 2 1 P21/n 11.93 4.2 6.5 6.1 -0.0 8.6 -3.9 -0.1 1.0 -0.1 6 10.3 33 benzeneO2 12 1 2 P21/c 10.17 0.6 3.3 3.4 -2.0 -2.2 4.6 0.0 -1.2 -0.3 9 4.4 20 benzodithiopheneO2 18 1 2 P21/n 11.50 -1.4 2.8 3.0 -2.5 1.7 -1.4 -0.0 -3.4 0.0 2 4.1 47 benzotrithiophene 21 1 1 P21/n 12.27 0.3 2.1 2.1 -1.7 2.2 1.2 0.0 1.6 -0.0 52 2.2 39 benzotrithiopheneA 21 2 1 P21 12.00 -0.4 2.7 2.8 -3.0 2.9 -0.8 -0.0 -1.8 0.0 33 3.8 35 bithiophene 16 1 2 P21/c 11.52 -2.3 16.8 16.6 20.9 -3.5 -13.7 -0.3 5.1 -0.5 6 15.0 40 BTBT 24 1 2 P21/c 10.75 0.8 5.0 5.0 1.2 6.0 -6.9 0.1 -2.0 -0.0 4 6.9 42 C60 60 1 6 Pa-3 11.53 1.2 0.0 0.4 0.4 0.4 0.4 0.0 0.0 0.0 1 0.1 32 carbazole 22 1 2 Pnma 8.98 2.5 0.6 1.2 1.6 0.7 0.2 -0.0 0.0 0.5 11 1.0 23 carbazoleNO2b 24 1 1 P21/n 9.57 0.1 21.2 21.3 12.1 -21.6 12.7 0.1 -13.8 -0.1 126 17.4 63 chrysene 30 1 2 C12/n1 9.18 2.6 1.1 2.0 1.4 -0.6 1.7 0.0 -0.8 0.0 13 0.7 28 coronene 36 1 2 P21/n 9.43 -1.9 21.2 20.6 5.2 -22.0 14.9 -0.0 -11.9 -0.1 6 24.7 29 DATT 48 1 1 P21 9.82 1.8 2.7 3.2 2.7 -3.0 2.0 0.7 -1.5 -0.2 63 3.8 70 DBTTF 26 1 2 P21/c 11.59 -1.1 4.3 4.0 4.3 -6.3 0.8 -0.2 -0.6 -0.1 2 5.4 87 dibenzoindigo 42 1 2 P21/n 9.34 1.8 1.5 1.9 -1.2 0.6 2.4 0.2 -3.1 0.1 26 3.9 75 DNBDT 42 1 2 P21/n 9.79 -0.1 4.4 4.4 1.3 -4.8 3.8 0.0 0.4 0.0 4 3.1 54 DNTT 36 1 1 P21 10.21 1.6 4.0 4.3 3.6 -4.0 2.4 3.2 1.5 0.2 97 5.9 55 hexacene 42 2 2 P-1 8.88 3.2 5.1 6.0 -1.8 -0.3 5.0 -0.5 -4.1 -1.6 19 6.0 45 HMTTF 28 1 1 P21/c 9.99 0.6 1.6 1.7 -1.2 -0.3 2.1 0.3 -0.6 -0.3 70 1.8 88 ICZb 32 1 2 P21/c 8.93 3.0 2.0 2.3 1.3 3.8 -2.0 -0.2 0.5 -0.1 12 3.5 26 ICZbCl2c 32 1 2 P21/c 10.06 2.5 3.8 4.3 3.5 2.7 -2.8 0.1 2.3 -0.0 2 3.3 38 IF12b 34 1 2 P21/n 8.96 2.9 0.3 1.2 0.7 1.1 1.0 0.1 0.3 0.0 7 0.9 26 IF21a 34 1 1 P21/c 9.36 2.0 5.0 5.0 9.2 -6.1 -0.3 0.2 2.3 -0.0 93 5.3 31 indigo 30 1 2 P21/n 9.34 3.5 3.1 3.0 -2.8 4.4 1.1 0.1 -1.7 0.1 2 2.1 56 indigoCl2 30 1 2 P21/c 10.72 1.4 13.7 14.2 14.4 -12.2 3.7 -0.3 4.0 0.0 3 10.1 70 naphthalene 18 1 2 P21/c 9.15 2.4 1.0 1.1 1.0 1.4 -0.5 0.0 -0.6 -0.1 9 2.3 15 NDFPh 44 1 2 P21/c 9.56 2.7 1.1 0.9 -0.1 1.1 1.6 0.3 -0.3 0.2 16 0.8 52 NDI 26 2 2 P-1 9.68 4.6 5.2 5.4 -0.7 -1.8 5.4 -3.2 1.5 3.6 32 2.8 39 NDT 24 2 2 P21/c 10.75 0.3 3.4 3.3 -3.1 3.3 0.3 -0.0 0.5 0.0 3 4.7 42 oligothiophene4 30 1 2 P21/a 11.55 -2.3 15.9 15.5 -18.5 6.5 11.5 -0.1 -3.9 -0.1 2 16.5 92 oligothiophene6 44 1 2 P21/a 11.53 -3.0 19.1 18.3 -21.5 9.9 12.1 0.3 -2.7 -0.4 2 22.6 138 OPV3CN 42 1 2 Pbca 9.88 1.3 1.3 2.0 1.4 -1.3 1.1 0.0 -0.0 -0.0 13 0.5 67 PBBTZ 30 1 1 P21/n 10.44 0.1 1.1 1.1 -1.7 0.3 1.2 -0.1 -1.3 0.1 30 3.4 82 PDI 40 1 2 P21/n 9.35 2.4 6.2 6.9 -8.4 5.1 6.3 -0.1 -2.1 -0.1 8 8.8 50 pentacene 36 2 2 P-1 8.98 2.6 4.4 5.0 -0.6 -1.3 4.1 1.8 -3.7 1.2 23 5.7 38 pentaceneN2Cl4 34 1 2 P21/n 11.61 2.5 2.6 3.1 -1.8 3.2 0.8 0.2 -4.2 -0.0 5 3.5 57 pentaceneN4O2 32 1 2 P21/n 9.62 1.7 1.6 1.4 -0.0 2.2 -0.4 -0.1 0.4 0.0 6 1.7 61 perylene 32 1 2 P21/c 8.98 2.0 0.9 1.2 1.5 0.4 0.3 -0.1 0.6 -0.0 2 1.7 23 phenazine 22 1 2 P21/n 9.50 1.0 2.0 2.0 -2.6 2.6 0.8 0.0 -0.8 -0.1 2 2.1 31 PTCDA 38 1 2 P21/c 9.73 2.7 3.5 3.3 5.3 1.2 -3.9 0.1 -1.8 -0.1 4 4.8 54 pyrene 26 1 1 P21/a 9.43 1.0 4.0 4.1 4.6 -4.0 0.5 -0.1 -0.5 0.0 94 2.4 23 quinacridone 36 1 2 P21/c 9.22 3.2 6.5 5.8 -5.2 8.0 0.2 -0.0 -2.7 -0.0 3 7.4 67 spirobifluorene 41 1 1 P21/c 9.92 1.4 1.6 1.6 -0.2 2.2 -0.7 1.1 -0.7 0.3 224 0.4 49 stilbene 26 2 2 P21/a 9.16 1.3 1.6 1.5 -1.4 1.5 0.6 -0.0 -0.8 0.0 10 1.4 34 TCNQ 20 1 2 C2/c 12.08 0.5 3.1 3.3 -1.4 -1.2 3.2 0.3 0.5 -0.6 16 3.5 50 TCNQ-F2 20 1 4 C2/m 12.26 3.2 3.3 3.1 -2.9 3.5 2.2 -0.2 -0.8 -1.2 6 1.0 57 TCNQ-F4 20 1 2 Pbca 13.13 1.4 3.0 2.8 -0.3 4.3 -2.5 0.0 -0.0 -0.0 13 1.6 45 tetracene 30 2 2 P-1 9.10 2.3 2.2 2.7 1.0 -1.1 2.7 0.7 -0.9 0.3 8 2.7 30 thiazolothiazolePh 30 1 2 P21/c 10.49 -0.9 4.6 4.2 -1.2 -1.7 2.6 0.0 1.4 -0.0 4 1.9 80 TPP 34 1 1 P21/c 9.89 -0.2 5.3 5.3 3.0 3.9 -6.7 -0.2 -2.7 0.0 79 2.6 149 triazine 9 1 2 C2/c 9.80 6.1 6.5 7.5 11.1 3.8 -3.1 -1.7 4.2 1.3 15 13.2 16 triphenylbenzene 42 1 1 Pna21 9.33 0.7 1.1 1.3 -1.6 0.4 1.9 0.1 -0.1 0.1 61 0.2 52 triphenylene 30 1 1 P212121 9.06 2.1 5.4 5.9 -6.1 7.7 1.0 0.1 -0.1 0.1 162 4.0 40 triphenyltriazine 39 1 1 P21/c 9.18 2.4 2.6 4.1 2.9 -2.4 2.0 0.1 0.2 -0.1 126 0.4 67 triptycene 34 1 1 P212121 9.57 1.9 1.0 1.6 1.1 -0.6 1.4 0.1 0.1 0.0 75 0.9 33 TTAa 36 1 2 P21/n 11.13 -0.2 1.7 1.8 -1.4 1.8 -0.7 -0.0 -1.3 -0.1 3 1.8 48 TTAb 36 1 2 P21/n 11.14 -0.2 5.8 5.8 -1.1 -5.3 6.8 -0.0 1.0 -0.0 5 2.3 49 TTF 14 1 2 P21/c 13.52 -1.4 3.1 2.6 1.8 -4.9 1.7 0.0 -0.4 0.0 5 2.2 67 TTPa 34 1 2 P21/n 11.51 0.6 1.6 1.5 -0.8 1.7 -0.3 -0.0 -1.4 -0.0 2 1.4 53 TTPb 34 2 2 P21/a 11.67 -1.4 5.1 4.7 5.2 -5.7 0.2 -0.1 1.2 -0.0 9 7.2 49 TTPc 34 1 1 P21 11.76 -0.0 3.1 3.0 0.2 -3.6 3.2 0.0 -1.0 0.1 88 1.2 59 TTTT 18 1 2 P21/n 12.57 -1.0 5.5 5.2 2.7 -7.9 5.1 -0.1 1.0 0.0 1 7.0 46