Archive of work produced using the resources of the Imperial College High Performance Computing Service.

DataCite Commons2020-09-04 更新50

Gaussian Calculation

DataCite Commons2020-06-29 更新30

Supplementary Dataset for: Enhancement of superexchange due to synergetic breathing and hopping in corner-sharing cuprates

铜酸盐超交换机制

量子化学计算

The following data are included in the dataset: Cluster geometries Point charge embedding files Inputs and output files Orbital files for calculations with large active spaces Data for density differe

Zenodo2021-11-19 更新10

Gaussian Job Archive for C59H93ClGeN4Si2

资源简介：

Gaussian Job Archive for C59H93ClGeN4Si2

资源简介：

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