return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Compare Bonds

18 10 26 16 45

G3B3 for rAlP

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


Differences greater than 0.060 are in the 0.060 bin. Differences less than -0.180 are in the -0.180 bin.

histogram chart 10
histogram chart 8
histogram chart 6
histogram chart 4
histogram chart 2
histogram chart 0 histogram chart
-0.180 -0.160 -0.140 -0.120 -0.100 -0.080 -0.060 -0.040 -0.020 0.000 0.020 0.040 0.060
bond length difference calc. - exp. (Å)

  Species Name Difference (Å)
Most negative difference AlP Aluminum monophosphide-0.164
Most positive difference AlP Aluminum monophosphide-0.164

Bond lengths
Click on entry for experimental details.

Species Name Experimental (Å) Difference (Å)
AlP Aluminum monophosphide 2.400 -0.164