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arxiv: 2608.06536 · 2 revisions

Density-Functional Excited-State Gradients and Nonadiabatic Couplings on a Consumer GPU from a Contraction-DAG

1. 2026-08-15 CONDITIONAL MODERATE v1.4.0-alltime-deepseek-medium novelty 7.0
   225047 ms 151 in 27369 out 2026-08-15T14:33:31.643070+00:00
2. 2026-08-10 CONDITIONAL MODERATE v1.4.0-alltime-deepseek-medium novelty 7.0
   168132 ms 187 in 15111 out 2026-08-10T04:17:53.608197+00:00