Table 6.
Volume fractions of six different quasi-atomistic models of micelles as obtained by OLIGOMER
| Sample | Molecule 1-c18 (model 1) | Molecule 1-c18 (model 2) | Molecule 1-c18 (model 4) | Molecule 1-c18 (model 5) | Molecule 2-c12 (model 5) | Molecule 1-c18 (model 6) |
|---|---|---|---|---|---|---|
| F2 (low amount of MA) | (22 ± 2) % | – | – | (22 ± 2) % | (18 ± 1) % | (38 ± 1)% |
| F2 (high amount of MA) | (30 ± 2) % | – | – | (16 ± 3) % | (10 ± 2) % | (44 ± 1) % |
| PS20 (low amount of MA) | (31 ± 2) % | (12 ± 3) % | (57 ± 2) % | – | – | – |
| PS20 (high amount of MA) | – | (70 ± 2) % | (30 ± 3) % | – | – | – |
| F4 (low amount of MA) | (52 ± 2) % | – | – | – | – | (48 ± 3) % |
| F4 (high amount of MA) | (44 ± 2) % | – | (56 ± 3) % | – | – | – |
The error estimates were obtained as a SD of optimized parameters from OLIGOMER runs using the angular range smax (2.5 ÷ 3.0) nm−1 corresponding to the number of Shannon channels in the fit (Nshannon = 5–6).