Research Data for "3D Visualisation of chemical shielding tensors (VIST) to elucidate local and global (anti)aromaticity"
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下载链接：
https://figshare.com/articles/dataset/Research_Data_for_3D_Visualisation_of_chemical_shielding_tensors_VIST_to_elucidate_local_and_global_anti_aromaticity_/13546826
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资源简介：
Research data underlying the manuscript "3D Visualisation of local aromaticity and antiaromaticity using chemical shielding tensors"
ContentMolecular coordinates (coord.xyz), Gaussian input files (gaussian.com), Gaussian output files (gaussian.log), and VMD input scripts (*.vmd) for benzene, phenanthrene, cyclobutaphenanthrene, PCT (paracyclophanetetraene), 8CPP (cycloparaphenylene), norcorrole_dimer.
创建时间：
2021-01-15
