Order Sequence of algorithms Parameters and tail corrections are included. Ewald summation is used for Coulombic interactions in GCMC, whereas a cutoff of 30 Å is used for cDFT. Four solver setups are considered to minimize the grand potential. These solver setups are used in a hierarchical order, if the previous solver setup failed to converge. These four solver setups are described in Table B 1 and are used in the order they appear in the table. It is possible that the 4 solver setups fail. In this event, these cases are reported and these failures are discussed.