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    JCC
    2006
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    Starting SCF calculations by superposition of atomic densities
    13 years 11 months ago
    Starting SCF calculations by superposition of atomic densities
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    : We describe the procedure to start an SCF calculation of the general type from a sum of atomic electron densities, as implemented in GAMESS-UK. Although the procedure is well kno...
    J. H. Van Lenthe, R. Zwaans, Huub J. J. Van Dam, M...
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