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• W2044579910 abstract "It is shown that the usual overlapping spheres method must include, in the monoelectronic potential, some overlap terms which are not present in the functional form of the muffin-tin potential. A new truncated spheres approximate projection is presented and compared with other projections which make use of muffin-tin-like potentials. Results are presented for the potential corrections in the atomic region of the H2 molecule and for some transition metal dihalides, where a comparison between the calculated transition state eigenvalues and the experimental photoelectron spectra is presented." @default.
• W2044579910 created "2016-06-24" @default.
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• W2044579910 date "2009-06-18" @default.
• W2044579910 modified "2023-09-25" @default.
• W2044579910 title "The MS potential from a set of overlapping densities" @default.
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• W2044579910 doi "https://doi.org/10.1002/qua.560160816" @default.
• W2044579910 hasPublicationYear "2009" @default.
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