To obtain an extrapolated value for AA, consider the case where one has more than enough data to obtain AA exactly. In this situation, for a carefully chosen r, C/(x) will have nearly zero slope for small x. since accumulating more x values will not change the estimate. Thus, one can hope to extrapolate AA by simply finding a value of r for which the slope d[C7(x)]/dx is the smallest for all x. then the extrapolated free energy AArci will be the value of C7(x) for the smallest value of X available, Xmin. [Pg.242]

© 2019 chempedia.info