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Virial Theorem for a Molecule (open access)

Virial Theorem for a Molecule

The usual virial theorem, relating kinetic and potential energy, is extended to a molecule by the use of the true wave function. The virial theorem is also obtained for a molecule from a trial wave function which is scaled separately for electronic and nuclear coordinates.
Date: May 1972
Creator: Ranade, Manjula A.
System: The UNT Digital Library