Periodic Boundary Conditions (PBC) for Face Centered Cubic (FCC) supercell sliced on the (111) plane

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孤独总比滥情好
孤独总比滥情好 2020-12-01 17:39

I have been trying to write and find an efficient way to impose periodic boundary conditions on an FCC supercell in the x-, and y-direction which is sliced on the (111) plan

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