Dear Users, I would like to perform tons of vc-relax calculations on a variety of compounds. I would like to have a reliable estimate of the memory usage before performing the calculations. I have already performed some vc-relax calculations, and I am wondering if there is any way to use these actual memory usage and find a functional form to estimate the memory usage for an unknown structure. For example, finding a functional form that depends on the number of atoms in the super cell.
Thanks! Reza
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