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Figure 1.
Figure 1. Radial distribution functions for low- and
high-pressure BPTI structures. The family 8 results are shown as
an illustration. Distances were calculated between all pairs of
atoms (including hydrogens) and placed into 0.1 Å bins. The
distributions were weighted by dividing the number in each bin
by the square of the radius. (A) The functions for the
low-pressure structure (solid line) and the high-pressure
structure (dashed line). (B) The difference (high - low), such
that a positive peak at any distance means that there are more
atom pairs at this distance in the high-pressure structure than
there are in the low-pressure structure.
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