TApplencourt
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d9ff8fae10
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Remove the db
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2016-01-15 10:15:45 +01:00 |
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TApplencourt
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f121c51b14
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Add dump, remove db
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2016-01-15 10:09:24 +01:00 |
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Thomas Applencourt
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e8609fbd6a
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Add all the transition metal
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2015-07-24 10:34:30 +02:00 |
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Thomas Applencourt
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f209aa9fc0
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Add CU
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2015-07-24 10:15:27 +02:00 |
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Thomas Applencourt
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c9cc04340a
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Now pseudo is in a gamess format
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2015-04-10 15:50:44 +02:00 |
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Thomas Applencourt
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27ec49df01
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Now pseudo is in a gamess format
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2015-04-10 14:48:22 +02:00 |
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Thomas Applencourt
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2848bb22e0
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Add cpdz
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2015-03-23 19:35:36 +01:00 |
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Thomas Applencourt
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0e7af4546e
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Add db/Pseudo for Burkatzki, Filippi and Dolg data
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2015-03-23 10:49:09 +01:00 |
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Thomas Applencourt
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789c8d1039
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New name format for db
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2015-03-17 16:11:59 +01:00 |
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Thomas Applencourt
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ec0fc43bf8
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Add format in db
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2015-03-16 19:10:55 +01:00 |
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Thomas Applencourt
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1729a48591
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Add rought estimation of number of basis
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2015-02-27 11:52:25 +01:00 |
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Thomas Applencourt
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7c6812f258
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New design for basis set
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2015-01-20 14:20:06 +01:00 |
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Thomas Applencourt
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80c69ae88a
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New db working
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2015-01-09 16:32:40 +01:00 |
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Thomas Applencourt
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cf1e3768d7
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New db
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2015-01-09 15:44:03 +01:00 |
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Thomas Applencourt
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426f847bf3
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New Working db
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2014-12-11 10:30:40 +01:00 |
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Thomas Applencourt
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45a26ba7e1
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Add the gaussian uk contracted databaset
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2014-11-20 15:34:46 +01:00 |
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Thomas Applencourt
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53aaf0cb71
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Version 0.1
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2014-11-12 14:30:26 +01:00 |