Development, implementation and applications of efficient methodologies for density functional calculations
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Elsevier
Reference91 articles.
1. The Wave Mechanics of an Atom with a non-Coulomb Central Field. Part III. Term Values and Intensities in Series in Optical Spectra
2. N�herungsmethode zur L�sung des quantenmechanischen Mehrk�rperproblems
3. New Developments in Molecular Orbital Theory
4. The molecular orbital theory of chemical valency VIII. A method of calculating ionization potentials
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