PCMSolute

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PCMSolute

Section Hamiltonian::PCM
Type logical
Default yes

This variable is a flag for including polarization effects of the solvent due to the solute. (Useful for analysis) When external fields are applied, turning off the solvent-molecule interaction (PCMSolute=no) and activating the solvent polarization due to the applied field (PCMLocalField=yes) allows to include only local field effects.


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