Atomic Screening Constants from SCF Functions

Keywords

Slater-type orbital, Atomic orbital, Atomic physics, Electron, Excited state

References

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• Studies in Molecular Structure. II. LCAO-MO-SCF Wave Functions for Selected First-Row Diatomic MoleculesBernard J. Ransil — 1960
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• Analytical Self-Consistent Field Functions for Positive Ions. II. Isoelectronic Series with 11 to 18 ElectronsE. Clementi — 1963
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• Experimental and theoretical charge density studies at subatomic resolution.Sylvie Honigman — 2011
• Mechanical Hardness: Atomic-level Calculations for Diamond-like MaterialsDaryl G. Clerc — 1998
• Electronic structure of linear halogen compoundsP. A. Straub, A. D. McLean — 1974
• Accurate density functional calculation of core electron binding energiesChristophe Bureau, Delano P. Chong, G. Lécayon — 1997
• Semiempirical molecular orbital calculations: The iron tricarbonyl polyene aldehyde isomers☆Abbas A. El-Awady — 1974
• Accurate density-functional calculation of core-electron binding energies with a scaled polarized triple-zeta basis setDelano P. Chong, Christophe Bureau — 2000
• The ellipsoidal Gaussian basis in molecular orbital theoryDrora Cohen, Harold Basch — 1978
• Sputter rate distribution and compositional variations in films sputtered from elemental and multi-element targets at different pressuresErik Särhammar, Erik Strandberg, Nicolas Martin — 2014
• Studies of EPR parameters for Mn5+ -doped Li3PO4 and Li3VO4 crystals.Zheng Wen-Chen, Xiao-Xuan Wu, Ying-Juan Fan — 2007
• Cryo-crystallography: diffraction at low temperature and more.Piero Macchi — 2012
• Spin-orbit coupling in chelates with conjugated ligandsMilan Kr�l — 1977
• Dynamique des électrons corrélés en champ laser intenseMichel Peters — 2012
• Orbitales localisées pour les interactions intermoléculairesEdrisse Chermak — 2012
• ab inito-Rechnungen über die Behinderung der freien Drehbarkeit der Methylgruppe in PropylenE. Zeeck — 1970
• On a property of gaussian wavefunctionsB. Tsapline — 1971
• The shape of atomic orbitalsLouis Chopin Cusachs, Haven S. Aldrich — 2009
• Coordination du silicium aux hydrocarbures aromatiques polycycliques : modélisations et expériences dans les conditions du milieu interstellaireBaptiste Joalland — 2011

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