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18 10 26 16 45

CCSD/aug-cc-pVQZ for rNaF

Histogram of Bond length differences (in Å) vs number of species


Differences greater than 0.110 are in the 0.110 bin. Differences less than -0.010 are in the -0.010 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart
-0.010 0.000 0.010 0.020 0.030 0.040 0.050 0.060 0.070 0.080 0.090 0.100 0.110
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference NaF sodium fluoride0.064
Most positive difference NaF sodium fluoride0.064

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
NaF sodium fluoride 1.926 0.064