HANDS-ON TUTORIAL ON THE PWscf/FPMD/CP ... - democritos
HANDS-ON TUTORIAL ON THE PWscf/FPMD/CP ... - democritos
HANDS-ON TUTORIAL ON THE PWscf/FPMD/CP ... - democritos
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Exercise 8O<strong>THE</strong>R SUGGESTI<strong>ON</strong>S FOR DIFFICOULT CASES:• Increase the number of calculated bands: nbnd=80• Change the mixing method mixing_mode or the size ofhistory mixing_ndim