0e0afdeb51
fixed typo and removed comment
2018-07-20 10:41:19 -06:00
b0c9fde1dd
more changes from Steve
2018-07-18 15:32:03 -06:00
ee98d026dc
preliminary documentation added (to be improved)
2018-07-09 14:28:25 -06:00
a52ddf8759
patch 29Jun18
2018-06-30 08:03:24 -06:00
ea35235ca0
couple more doc tweaks - sigh
2018-06-29 16:12:25 -06:00
d2dd76e655
added SPIN package to Section_packages doc
2018-06-29 14:56:27 -06:00
6900f9edf9
Merge branch 'master' into collected-small-changes
2018-06-29 14:59:02 -04:00
ec99b0957c
new ARM makefiles, also some doc tweaks
2018-06-29 08:06:51 -06:00
6bd5a3d69b
Merge pull request #935 from julient31/spin_origin
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Spin origin
2018-06-27 16:58:27 -06:00
264f832b18
fix formatting of dump_modify docs
2018-06-27 07:58:57 -04:00
8e14143908
Merge pull request #925 from PabloPiaggi/pair_entropy
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Pair entropy fingerprint
2018-06-26 13:16:09 -06:00
e2622f0230
Remap the paragraph
2018-06-26 17:27:55 +03:00
e4dd6dec40
Refine the documentation
2018-06-26 16:36:16 +03:00
c9d147c366
New paramteters for potential #839
2018-06-26 11:09:48 +03:00
86519ce213
Rename compute to entropy/atom
2018-06-24 00:25:07 +02:00
d237625d2a
patch 22Jun18
2018-06-22 14:08:09 -06:00
510834cb7b
Merge pull request #960 from lammps/latte-tweak
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made latte.in compatible with v1.1.1 and updated log files
2018-06-22 10:18:19 -06:00
f5f73b0172
Merge pull request #958 from ndtrung81/gpu-updates
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Bug fixes and updates to the GPU package
2018-06-22 08:52:20 -06:00
cbfb751e92
made latte.in compatible with v1.1.1 and updated log files
2018-06-21 11:10:29 -06:00
a9b794b2ab
Updates to the core-shell gpu pair styles
2018-06-20 10:43:13 -05:00
d4861e71d2
integrate SPIN package into documentation, fix links and make it consistent
2018-06-18 18:36:30 -04:00
605b4dca22
fix overlooked merge conflict
2018-06-18 18:09:59 -04:00
dade67664d
restore bugfix for refrences
2018-06-18 18:07:26 -04:00
93d6510d34
restore deleted file
2018-06-18 18:02:40 -04:00
4f8d1893e9
restore fix for formatting cleanup
2018-06-18 18:01:28 -04:00
7c7a80b31a
restore deleted file
2018-06-18 17:59:22 -04:00
03a7d1cd5d
Merge pull request #933 from rtoijala/fix_dt_reset_energy
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Limit atom energy change in fix dt/reset
2018-06-18 13:43:03 -06:00
08331da93d
Merge pull request #950 from martok/subst-equal-fmt
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Add support for inline format strings to immediate variable substitution
2018-06-18 13:42:24 -06:00
ab0f3debeb
Merge pull request #948 from martok/variable-string
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Variable style 'string' substitutes variables in definition
2018-06-18 10:50:36 -06:00
c4bcb7e73d
mention requirement to come after the box creation in Restrictions section
2018-06-15 17:52:54 -04:00
18b543179c
fix typo
2018-06-15 17:47:23 -04:00
14c4438a72
update docs to reflect the state of reserving space for topology info with molecule files
2018-06-15 17:46:09 -04:00
5fcdfe6dcb
describe the use of wildcards for adapting ranges of bond types
2018-06-15 17:35:43 -04:00
8a2faff541
integrate compute pentropy/atom into the documentation tree
2018-06-15 16:40:25 -04:00
c5b51df06e
Add support for inline format strings to immediate variable substitution
2018-06-14 14:17:37 +02:00
3e79296dcf
Variable style 'string' substitutes variables in definition
2018-06-14 13:10:08 +02:00
56c3a0be29
support virtualenv on machines with python3 where it is called virtualenv-3
2018-05-31 19:03:28 -04:00
cf3095e938
document restartinfo bug message, add check to Pair::write_restart as well
2018-05-31 19:02:03 -04:00
38182dcc60
clarify docs on what energy is monitored
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changes to the energy only consider the kinetic energy, so make that explicit in the augmented `fix dt/reset` docs
2018-05-31 17:32:19 -04:00
f2a6aa249f
Commit2 JT 052918: doc
2018-05-29 17:18:45 -06:00
b9a8f91753
Limit atom energy change in fix dt/reset
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Allow limiting of the maximum energy change of an atom in
fix dt/reset in addition to the existing distance limit.
Useful especially for high-energy irradiation.
2018-05-28 10:57:40 +03:00
6de4569483
Removed unused variables - corrected documentation
2018-05-22 17:29:51 +02:00
e550f5120b
Updated docs
2018-05-22 12:44:40 +02:00
1641f78e3e
Merge from lammps master
2018-05-21 16:06:53 -06:00
cab602045e
tweaks to doc pages
2018-05-18 08:37:29 -06:00
124641dc8a
Examples - new local option
2018-05-18 15:13:48 +02:00
363d8ef775
tweaks1
2018-05-13 15:45:43 -06:00
a449488b1d
simplify
2018-05-13 12:14:15 -06:00
e076d08ee9
correctly render doc page
2018-05-12 14:17:29 -06:00
ca6920be72
Merge pull request #907 from akohlmey/dump_maxfile
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Implement 'dump_modify maxfiles' feature
2018-05-12 12:59:33 -06:00
