Emmanuel Giner
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3d3cc92cce
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added the remaining singlets in AVTZ for ethylene
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2018-12-14 00:26:14 +01:00 |
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Emmanuel Giner
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4fbfb82d84
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Merge branch 'master' of https://github.com/pfloos/srDFT
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2018-12-14 00:17:23 +01:00 |
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Emmanuel Giner
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a4c6e402c9
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added ethyelene and classified the data
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2018-12-14 00:17:10 +01:00 |
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eginer
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9253a16030
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added the data_ethylene
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2018-12-11 16:24:24 +01:00 |
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eginer
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2e0ccf9827
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added data_water_sorted
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2018-12-10 13:32:04 +01:00 |
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Emmanuel Giner
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87bd4bd9e2
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Merge branch 'master' of https://github.com/pfloos/srDFT
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2018-12-05 18:14:16 +01:00 |
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Emmanuel Giner
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633d185990
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added data
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2018-12-05 18:14:12 +01:00 |
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Pierre-Francois Loos
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39a18d3abb
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Adding references
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2018-12-04 20:49:53 +01:00 |
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Pierre-Francois Loos
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ad457ef2ef
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few stuff
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2018-12-04 15:28:59 +01:00 |
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Pierre-Francois Loos
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a77310d625
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Initial commit by T2
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2018-11-30 23:43:13 +01:00 |
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e880720a83
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Initial commit
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2018-11-30 23:41:14 +01:00 |
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