Daniel Bauer
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1df8983972
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small and big fixes :)
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2017-02-15 22:40:10 +01:00 |
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Daniel Bauer
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1976ff1730
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fixed mc
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2017-02-04 01:27:17 +01:00 |
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Daniel Bauer
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d991ded220
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fixed virial test
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2017-02-04 01:00:28 +01:00 |
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Daniel Bauer
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60733f3531
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comments
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2017-02-04 00:48:22 +01:00 |
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Daniel Bauer
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de10169e06
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qwerty
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2017-02-03 14:57:05 +01:00 |
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Daniel Bauer
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c471de3fe1
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widom does oneinsertion per default now
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2017-02-03 10:59:05 +01:00 |
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bauer
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ea93de98b2
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tension results
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2017-02-03 09:08:31 +01:00 |
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bauer
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8e528c71eb
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more results
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2017-02-03 08:54:27 +01:00 |
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danijoo
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e6eaa62a62
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surface tension reimplemented as running average (and maybe correct values now)
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2017-02-02 18:56:00 +01:00 |
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danijoo
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8b9aa858ca
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widom fixes
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2017-02-02 16:48:54 +01:00 |
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danijoo
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af264ddef5
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move trj
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2017-01-30 09:40:59 +01:00 |
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danijoo
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8b7d2ec1a2
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some fixes and updates
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2017-01-30 09:40:35 +01:00 |
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danijoo
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aa507b6278
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trjconv can now skip frames
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2017-01-28 20:00:39 +01:00 |
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danijoo
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a6630b0234
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at vacuum space at very beginning
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2017-01-28 19:59:49 +01:00 |
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danijoo
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81054e5551
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fixed distance calculation over pbc
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2017-01-28 19:57:11 +01:00 |
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Daniel Bauer
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6f94757535
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Merge branch 'master' of https://github.com/danijoo/lj_monte_carlo
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2017-01-27 15:11:42 +01:00 |
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Daniel Bauer
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98bd75ebfd
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forgot what this commit is about
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2017-01-27 15:11:29 +01:00 |
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danijoo
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5832b0f7ff
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Delete mclj.iml
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2017-01-24 00:03:04 +01:00 |
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danijoo
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7542a0761f
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Update README.md
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2017-01-24 00:02:28 +01:00 |
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Daniel Bauer
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b68e4be2a3
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readme
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2017-01-24 00:01:32 +01:00 |
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Daniel Bauer
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409efbcbd4
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FoS
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2017-01-23 23:54:57 +01:00 |
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danijoo
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29768e5d1e
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surface tension fix
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2017-01-23 21:46:45 +01:00 |
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danijoo
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72ca57d357
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cargo binaries
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2017-01-23 08:59:48 +01:00 |
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danijoo
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cd94c50fb2
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surface tension and widom particle insertion (WIP)
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2017-01-23 08:59:29 +01:00 |
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danijoo
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e73d347b8b
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Merge branch 'master' of https://github.com/danijoo/lj_monte_carlo
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2017-01-22 03:38:49 +01:00 |
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danijoo
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f75fb8ac54
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typo
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2017-01-22 03:37:31 +01:00 |
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danijoo
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cf1a901fcf
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fixed vacuum space initial conditions
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2017-01-22 01:47:13 +01:00 |
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danijoo
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9767d3bab4
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fixed some output problems
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2017-01-22 01:40:47 +01:00 |
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danijoo
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23673a1691
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Create LICENSE
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2017-01-22 01:15:23 +01:00 |
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danijoo
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f1c1fb7306
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readme
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2017-01-22 01:07:39 +01:00 |
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danijoo
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757ba2ba9f
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script to filter trajectories
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2017-01-22 01:07:15 +01:00 |
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danijoo
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ee1061f5b7
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vacuum slab
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2017-01-22 01:00:26 +01:00 |
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danijoo
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93bfc18b89
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writing trajectories
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2017-01-22 00:50:15 +01:00 |
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danijoo
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1d38e85964
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Cmd args and nice output alignment
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2017-01-21 15:36:53 +01:00 |
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danijoo
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96783abf5e
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scale displacement
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2017-01-21 14:58:22 +01:00 |
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danijoo
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08fa9bd150
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better output
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2017-01-21 14:43:14 +01:00 |
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danijoo
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bc455738f4
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support of differnt box dimensions
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2017-01-21 14:36:54 +01:00 |
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danijoo
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ff4e56ad8b
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gitignore
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2017-01-21 14:18:13 +01:00 |
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danijoo
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f95c1da06a
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initial
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2017-01-21 14:03:08 +01:00 |
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