Grid data for reproducing results of "Toy models reveal intrinsic biases in NICS: insights to verify NICS interpretations"
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Grid data for reproducing molecular system results in the manuscript "Toy models reveal intrinsic biases in NICS: insights to verify NICS interpretations". Corresponding gaussian input and output files, as well as some visualisations of the data are also present. How to use:Unzip data.zip and place the entire data/ folder directly into the repository root of the associated github code repository (https://github.com/GQCG-res/toy-models-NICS-bias). With this folder structure, all notebooks inside the github repository can run directly.
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Zenodo创建时间:
2026-05-05



