Concepedia

Correlation and Relativistic Effects in β-PbO and Other Lead (II) Oxides: A Quantum ab Initio Explanation of 207Pb NMR and XANES Spectra

Cecil Dybowski, S. G. Kozlova, G. Neue, Dale L. Perry, Victor V. Terskikh

Journal of Solid State Chemistry · 2001 · 16 citations · 21 references

DOI

Concepts

References

21

The influence of polarization functions on molecular orbital hydrogenation energies

P. C. Hariharan, John A. Pople · Theoretical Chemistry Accounts · 1973 · 15.7K citations

, , +14

<i>Ab initio</i> effective core potentials for molecular calculations. Potentials for main group elements Na to Bi

Willard R. Wadt, P. Jeffrey Hay · The Journal of Chemical Physics · 1985 · 10K citations

, , +17

Magnetic Shielding of Nuclei in Molecules

Norman F. Ramsey · Physical Review · 1950 · 1.4K citations

, , +5

Principles of magnetic resonance

W.S.B · Journal of Magnetic Resonance (1969) · 1979 · 656 citations

, , +11

Orbital-invariant formulation and second-order gradient evaluation in M�ller-Plesset perturbation theory

Péter Pulay, Svein Saeb� · Theoretical Chemistry Accounts · 1986 · 545 citations

, , +13