IV.D.4. (XII.A.2.) |
Compare Bonds
18 10 19 16 31G3B3 for rLiF
Histogram of Bond length differences (in Å) vs number of species
Differences greater than 0.006 are in the 0.006 bin. Differences less than -0.018 are in the -0.018 bin.
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8 | ||||||||||||||||||||||||||||||||||||||||
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2 | ||||||||||||||||||||||||||||||||||||||||
0 | ||||||||||||||||||||||||||||||||||||||||
-0.018 | -0.016 | -0.014 | -0.012 | -0.010 | -0.008 | -0.006 | -0.004 | -0.002 | 0.000 | 0.002 | 0.004 | 0.006 | ||||||||||||||||||||||||||||
bond length difference calc. - exp. (Å) |
Species | Name | Difference (Å) | |
---|---|---|---|
Most negative difference | LiF | lithium fluoride | -0.017 |
Most positive difference | LiF | lithium fluoride | -0.012 |
Bond lengths
Click on entry for experimental details.
Species | Name | Experimental (Å) | Difference (Å) |
---|---|---|---|
LiF | lithium fluoride | 1.564 | -0.017 |
LiF | lithium fluoride | 1.564 | -0.012 |