Solution of the extended Thomas-Fermi model for triatomic molecules

B. Jacob*, R. M. Dreizler, E. K.U. Gross

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

2 Scopus citations

Abstract

Presents a solution of the Thomas-Fermi-Dirac-Weizsacker equation with three-centre boundary conditions for the molecules H2O and SO 2. The solution is compared with previous results using the simple Thomas-Fermi model and with LCAO/MO calculations.

Original languageAmerican English
Article number005
Pages (from-to)2753-2759
Number of pages7
JournalJournal of Physics B: Atomic and Molecular Physics
Volume14
Issue number16
DOIs
StatePublished - 1981
Externally publishedYes

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