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Compare Calculated Bonds for Li-Li

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HSEh1PBE/6-31G(2df,p)

Histogram of Bond lengths (in Å) vs number of species


Values greater than 2.98 are in the 2.98 bin. Values less than 2.74 are in the 2.74 bin.

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2.74 2.76 2.78 2.80 2.82 2.84 2.86 2.88 2.90 2.92 2.94 2.96 2.98
bond lengths (Å)

Summary: (Å)
Average bond length Standard deviation
2.882 0.103

  Species Name Bond Length (Å)
Lowest value Li2 Lithium diatomic 2.749
Highest value Li3+ Lithium trimer cation 2.984

Calculated Bond lengths
Click on entry for all calculated results.
Species Name Bond Length (Å) Atom1 index Atom2 index
Li2 Lithium diatomic 2.749 1 2
Li3 Lithium trimer 2.797 1 2
    2.797 1 3
Li3+ Lithium trimer cation 2.984 1 2
    2.984 1 3
    2.984 2 3