TABLE I.
Selected simulation details for KBFF-SPC/E runs.
Nominal urea concentration (M) |
Actual urea concentration (M) |
N (urea) | N (water) | Average box length (nm) |
---|---|---|---|---|
0 | 0.00 | 0 | 2213 | 4.0494 |
0.5 | 0.52 | 21 | 2163 | 4.0508 |
4 | 4.02 | 161 | 1818 | 4.0510 |
8 | 8.03 | 321 | 1420 | 4.0493 |