Stefan Riemelmoser1,2, Carla Verdi1,3,4, Merzuk Kaltak5

  • 1Faculty of Physics and Center for Computational Materials Science, University of Vienna, Kolingasse 14-16, A-1090 Vienna, Austria.

概括

机器学习模拟随机相近似 (RPA) 来创建一个更容易访问的密度函数. 这种ML-RPA方法实现了对钻石表面的高精度,扩大了计算化学能力.

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Mechanistic Models: Compartment Models in Algorithms for Numerical Problem Solving

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