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S 2 SCF

S2SCF

The value of $\langle S^2 \rangle$ for the reference wavefunction.

Data type: floating point. Dimension: 1. Written by: xvscf.

For variable definition see: Terms of reference.

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Page last modified on June 18, 2011, at 07:11 PM
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CFOUR is partially supported by the U.S. National Science Foundation.