Modelling vibrational dissociation of [H2-HCO]+
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Supporting information for the article. Archives figure_*.tar.gz contain data used to generate all Figures in the manuscript. Archive python_tools.tar.gz contains supplementary python scripts to process trajectory files, and to plot figures. Archives runs_*.tar.gz contain raw data from CPMD calculations. They are grouped by method and excited bond. See README for details.
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Zenodo创建时间：
2018-06-21
