Table 4.
RF | P3M | |||||||
500–1000 | 500–1500 | 500–2000 | 500–1000 | 500–1500 | 500–2000 | |||
50% | RF | 500–1000 | 100 | 91.1 | 88.2 | 98.9 | 90.1 | 86.8 |
500–1500 | 100 | 97.1 | 90.6 | 99.2 | 96.2 | |||
500–2000 | 100 | 88.4 | 96.9 | 99.5 | ||||
P3M | 500–1000 | 100 | 91.0 | 87.9 | ||||
500–1500 | 100 | 97.0 | ||||||
500–2000 | 100 | |||||||
70% | RF | 500–1000 | 100 | 96.5 | 88.5 | 89.9 | 89.9 | 87.0 |
500–1500 | 100 | 88.4 | 88.8 | 89.7 | 87.1 | |||
500–2000 | 100 | 95.9 | 96.1 | 97.2 | ||||
P3M | 500–1000 | 100 | 98.0 | 97.4 | ||||
500–1500 | 100 | 98.8 | ||||||
500–2000 | 100 |
Overlap between the major essential modes calculated for different intervals (psec) of the two MD simulations. The major modes are those accounting for either 50% or 70% of the total mean-square fluctuations (see Table 3). The overlap is expressed in percent.