Journal
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
Volume 95, Issue 6, Pages 877-881Publisher
WILEY-BLACKWELL
DOI: 10.1002/qua.10622
Keywords
many-electron systems; monotonic electron density decay; local effective potential
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For one-electron systems, if the external potential increases monotonically from the nucleus the ground-state electron density is monotonic. For two-electron densities, similar results hold for the Kohn-Sham potential. Similarly, for many-electron systems monotonicity of the sum of the Kohn-Sham potentials and Pauli potential (from the correction to the Weisacker kinetic energy) is sufficient for monotonic decay of the electron density. (C) 2003 Wiley Periodicals, Inc.
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