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rfinetune + jj2lsj_2022 update

Open jongrumer opened this issue 2 years ago • 0 comments

This PR adds the tool/rfinetune code and necessary modifications to the apps/jj2lsj transformation routine. See Y. Li Atoms 2023, 11(4), 70 for details.

As mentiioned the updates also include a new version of jj2lsj which adds the non-default option of saving jj-LSJ transformation information in a lsj.T file.

/Jon

jongrumer avatar Apr 21 '23 06:04 jongrumer