Table 1: Solubility parameters for P3HT and CNPh-PPV.
|
MD Simulation (cal1/2/cm3/2) |
Synthia Calculation (cal1/2/cm3/2) |
Experimental |
P3HT |
15.66 |
18.71a |
13.4 ± 0.3b |
CNPh-PPV |
15.02 |
17.98a |
- |
aValues calculated by using the method Van Krevelen of Synthia; bExperimental value from [18]