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PCMKick

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PCMKick

Section Hamiltonian::PCM
Type logical
Default no

This variable controls the effect the kick has on the polarization of the solvent. If .true. ONLY the FAST degrees-of-freedom of the solvent follow the kick. The potential due to polarization charges behaves as another kick, i.e., it is a delta-perturbation. If .false. ALL degrees-of-freedom of the solvent follow the kick. The potential due to polarization charges evolves following an equation of motion. When Debye dielectric model is used, just a part of the potential behaves as another kick.

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