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- W2470152093 abstract "In the study of the N20 molecule with an Ih symmetry group, the following methods were applied: 6-31G, 3-21G and STO-3G ab initio and PM3 semiempirical MO methods. Both geometrical optimization and frequency calculations are reported. Results of optimized bond distances (dNN), first ionization potential, ΔHa, ΔGa and bond energy, for the cases of 6-31G, 3-21G, and PM3 showed that the N20 molecule is a highly stable compound with a delocalized NN single bonded cluster structure." @default.
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- W2470152093 date "1995-09-01" @default.
- W2470152093 modified "2023-09-25" @default.
- W2470152093 title "Theoretical study of the N20 molecule" @default.
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- W2470152093 doi "https://doi.org/10.1016/0166-1280(95)04221-q" @default.
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