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grimme-lab / cefine Public

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v2.22

cefine in version 2.22

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fabothch released this 09 Jul 10:56

· 29 commits to master since this release

5a97960

This commit was created on GitHub.com and signed with GitHub’s verified signature. The key has expired.

GPG key ID: 4AEE18F83AFDEB23

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Added -fpol functionality: remove all f functions from def2-TZVPD basis set.

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