2:42:22 AM PST - Wed, Mar 4th 2015 |
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The CRENBL ECP basis set of the "1D UNCONTR" variety has some missing element names.
It has ELEMETN113 (sic) instead of UNUNTRIUM,
ELEMENT115 instead of UNUNPENTIUM,
ELEMENT117 instead of UNUNSEPTIUM.
This only matters in programs that include the names in basis sets, like GAMESS, but it causes some confusion trying to parse the data.
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