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1f62b3f740
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Update and fix QUEST#5 data
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2020-11-04 15:42:53 +01:00 |
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6f2e635e26
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Fix hexatriene geom
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2020-10-27 16:48:46 +01:00 |
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a973526f20
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Fix Oscillator strength typo
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2020-10-08 18:36:03 +02:00 |
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07a389de77
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Oscilator forces becomes Oscilator strenght
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2020-09-22 10:05:05 +02:00 |
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1fe9de068b
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Some index fixes in data excitations
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2020-09-21 17:03:58 +02:00 |
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dbd8facf06
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Change sets handling
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2020-09-20 17:54:16 +02:00 |
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2b6cac3799
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Add name to QUEST#5 article
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2020-09-09 18:02:06 +02:00 |
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d337def426
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Add geometries metadata for QUEST#5
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2020-09-01 17:39:29 +02:00 |
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f5ecda8d98
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Fix QUEST#5 data
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2020-08-13 11:00:49 +02:00 |
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7f014e4209
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Fix unsafe for QUEST#5
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2020-08-10 11:51:31 +02:00 |
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514d5e4192
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Add QUEST#5 data
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2020-07-23 17:27:44 +02:00 |
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