KdotPCalcSecondOrder

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KdotPCalcSecondOrder

Section Linear Response::KdotP
Type logical
Default false

If true, calculates second-order response of wavefunctions as well as first-order response. Note that the second derivative of the Hamiltonian is NOT included in this calculation. This is needed for a subsequent run in CalculationMode = em_resp with EMHyperpol.


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