Dataset - B2FIND

Supporting Data for: Cavity-free continuum solvation: implementation and para...

Supplementary material to an article submitted for review, about the PCM implementation in the MRChem software (https://github.com/MRChemSoft/mrchem), entitled "Cavity-free...
Replication Data for: Fully Polarizable QM/Fluctuating Charge Approach to Two...

This dataset contains raw input and output files for the LSDALTON calculations reported in "Fully Polarizable QM/Fluctuating Charge Approach to Two-Photon Absorption of Aqueous...

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2 datasets found