Peter Reinholdt1, Karl Michael Ziems2,3, Erik Rosendahl Kjellgren1

  • 1Department of Physics, Chemistry and Pharmacy, University of Southern Denmark, Campusvej 55, DK-5230 Odense M, Denmark.

概括

量子选择配置相互作用 (QSCI) 方法显示了量子化学的局限性. 数字分析揭示了在寻找新配置方面的低效率,阻碍了与经典方法相比的实际应用.

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