CasidaTheoryLevel

A - B - C - D - E - F - G - H - I - K - L - M - N - O - P - Q - R - S - T - U - V - W - X

CasidaTheoryLevel

Section Linear Response::Casida
Type flag
Default eps_diff + petersilka + lrtddft_casida

Choose which electron-hole matrix-based theory levels to use in calculating excitation energies. More than one may be used to take advantage of the significant commonality between the calculations. variational and lrttdft_casida are not usable with complex wavefunctions. Note the restart data saved by each theory level is compatible with all the others.

Options:


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