Electronic pair correlation in atoms and molecules
- R.K. Nesbet
- 2009
- International Journal of Quantum Chemistry
Publications
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.
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56 results at International Journal of Quantum Chemistry
Green's function scattering‐theoretic methods for point defects, surfaces, and interfaces in solids
- S.T. Pantelides
- J. Bernholc
- et al.
- 2009
- International Journal of Quantum Chemistry
Variational methods in the computation of energy bands
- Paul M. Marcus
- 2009
- International Journal of Quantum Chemistry
Ground states of linear molecules: Dissociation energies and dipole moments in the hartree–fock approximation
- M. Yoshimine
- A.D. Mclean
- 2009
- International Journal of Quantum Chemistry
A method for improving the physical realism of first‐principles band structure calculations
- F. Herman
- I.B. Ortenburger
- et al.
- 2009
- International Journal of Quantum Chemistry
Evaluation techniques for quantum mechanical integrals
- Tien Chi Chen
- 2009
- International Journal of Quantum Chemistry
Correlation and multiplet hole theory of core‐electron energy splittings in transition‐metal ions
- P.S. Bagus
- A.J. Freeman
- et al.
- 2009
- International Journal of Quantum Chemistry
Potential curve for linear symmetric H3
- B. Liu
- 2009
- International Journal of Quantum Chemistry
Study of the electronic structure of molecules. XI. Comments on some present aspects and tentative extrapolations
- E. Clementi
- 2009
- International Journal of Quantum Chemistry
Correlation effects in electron scattering and attachment by open‐shell atoms
- R.K. Nesbet
- 2009
- International Journal of Quantum Chemistry