This dataset contains training data for the multi-task constraining model for the QM descriptors on-the-fly computations. https://github.com/yanfeiguan/chemprop

DataCite Commons2020-08-25 更新210

Source data of Green's function and figure files.

量子力学

格林函数计算

In the article of "The role of electron-electron interactions in two dimensional Dirac fermions", we present the analysis of the unequal time Green's function to find the Fermi velocity according to t

DataCite Commons2020-09-02 更新120

THE HYLLERAAS METHOD FOR TWO ELECTRONS ATOMS

量子力学

数值方法

The quantum mechanics of two electrons atoms, as suggested by E. A. Hylleraas in the period between 1928-1930, is discussed in the present work. Hylleraas introduced explicit correlations in the wavef

DataCite Commons2020-08-31 更新260

Feibelman d-parameters for crystalline noble metals

量子力学

光学响应

Tabulated Feibelman d-parameters obtained from quantum mechanical optical response simulations of a noble metal surfaces having either (100) and (111) crystallographic orientation as described by 1-D

DataCite Commons2022-05-31 更新130

QM Origin of Gravity and Time Dilation

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