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- W2082391008 abstract "The PCILO method is used for the study of molecular systems with translational symmetry in a two-dimensional lattice. The calculation for the whole crystal is reduced to the calculation of unit cell pairs. By using the translational symmetry and the first-neighbour approximation, one shows that only four unit cell pairs have to be considered. The procedure described yields the ground-state energy and the charge distribution of the unit cell." @default.
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- W2082391008 date "1976-09-01" @default.
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- W2082391008 title "Crystal calculation using thePCILO method" @default.
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- W2082391008 doi "https://doi.org/10.1002/qua.560100518" @default.
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