Concepedia

Second row molecular orbital calculations

Fred J. Marsh, Mark S. Gordon

Journal of Molecular Structure · 1976 · 23 citations · 10 references

DOI

Concepts

References

10

Approximate Self-Consistent Molecular Orbital Theory. III. CNDO Results for AB2 and AB3 Systems

John A. Pople, Gerald A. Segal · The Journal of Chemical Physics · 1966 · 1.9K citations

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Approximate Self-Consistent Molecular-Orbital Theory. V. Intermediate Neglect of Differential Overlap

John A. Pople, D. L. Beveridge, Paul A. Dobosh · The Journal of Chemical Physics · 1967 · 1.5K citations

, , +13

Approximate Self-Consistent Molecular Orbital Theory. IV. Calculations on Molecules Including the Elements Sodium through Chlorine

D. P. Santry, Gerald A. Segal · The Journal of Chemical Physics · 1967 · 516 citations

, , +17

Approximate Self-Consistent Molecular-Orbital Theory. VI. INDO Calculated Equilibrium Geometries

Mark S. Gordon, John A. Pople · The Journal of Chemical Physics · 1968 · 117 citations

, , +13

Complete neglect of differential overlap calculations on second-row molecules

D. P. Santry · Journal of the American Chemical Society · 1968 · 93 citations

, , +4