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min to 5 for an spd basis set, 10 for an spdf basis set, and so forth. To freeze inner-shell electrons, replace 8/10=90 by 8/10=2.
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min to 5 for an spd basis set, 10 for an spdf basis set, and so forth. To freeze inner-shell electrons, replace "8/10=90" by "8/10=2".
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