A multiscale light-matter dynamics software on Aurora claims 152x and 3,780x speedups and 1.87 EFLOP/s, but the performance comparisons and peak-efficiency figure are questionable.
QM/MM can be formulated as extrapolation in a metamodel space, where the two axes are model accuracy and problem size [31, 32, 50]
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Multiscale light-matter dynamics in quantum materials: from electrons to topological superlattices
A multiscale light-matter dynamics software on Aurora claims 152x and 3,780x speedups and 1.87 EFLOP/s, but the performance comparisons and peak-efficiency figure are questionable.