LCPQ/qp2
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2,080 Commits 30 Branches 18 Tags 80 MiB
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4 Commits

Author SHA1 Message Date
Emmanuel Giner LCT
2e32cd2267 changed some radiis for DFT 2019-08-30 20:00:29 +02:00
Anthony Scemama
96c17686b4 fixed bugs with dummy atom and becke grid 2019-05-28 18:49:21 +02:00
Emmanuel Giner
02968f569e fixed bug for dummy atoms X 2019-03-27 12:56:32 +01:00
Anthony Scemama
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00