From: Karol L. <kar...@gm...> - 2021-10-20 01:24:31
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Hello everyone, It's my pleasure to let you know that we recently released v1.7.1 of cclib. The main improvements this time around were one new parser (formatted checkpoint files) and a few new attributes (related NMR chemical shielding tensors). You can find the release and all details at: https://github.com/cclib/cclib/releases/tag/v1.7.1 Best regards, cclib developers |