ResearchBenchmarksCCSD solver convergence on Amino acids (out-of-distribution)Follow3.83Average CyclesMōLe3.67884.69945.726.7406Feb 23, 2026Evaluation ResultsMethodMethodLinksAverage CyclesNumber UnconvergedMōLeUsage=Initial guess fo...Usage=Initial guess for CCSD solver2026.023.830MP2Usage=Default guessUsage=Default guess2026.027.610