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ChemCam LIBS dataset
The dataset used in the paper is a LIBS (Laser-Induced Breakdown Spectroscopy) dataset, which contains raw and denoised spectra obtained from a variety of targets (e.g., rocks,... -
RADAR (Research Data Repository)
Imported
Td-dft for pzx-tolan and geometry optimization for radicals
Abstract: This dataset contains (TD-)DFT calculations for a series of N-Tolanyl-phenochalcogenazines PZX in neutral and radical form with two different geometries. For the...
