6dad2f59d8
list @HaoZeke as (new) owner of the LAMMPS emacs mode list code
2018-07-31 11:06:09 +02:00
50fe209782
mention -*- cookie for switching emacs modes and clarify file pattern text
2018-07-31 10:24:36 +02:00
24e293326d
Remove disabled line and add comment on package dependencies
2018-07-31 09:36:35 +02:00
f3615e83e8
move pair style eam/cd from USER-MISC to MANYBODY and update docs accordingly
2018-07-31 09:18:37 +02:00
18a7b1ab4f
Fix broken links and duplicate TOC
2018-07-30 21:32:12 -04:00
57cd1ab55a
Add missing extension
2018-07-30 19:13:26 -04:00
34f619ea1d
Update lammps.book
2018-07-30 19:04:52 -04:00
a8e2a0a54b
Merge pull request #1019 from rbberger/cmake_updates
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CMake updates
2018-07-30 15:18:47 -06:00
d9c328932f
changes to Packages and Speed doc files
2018-07-30 12:31:12 -06:00
ee822bec1b
selectively handle dependency of qeq/fire on MANYBODY
2018-07-30 20:04:31 +02:00
b02362b943
add manual treatment of source dependencies between USER-REAXC and USER-OMP
2018-07-30 19:09:16 +02:00
82c9e8a52c
add explicit pattern based dependencies for CORESHELL packages, so KSPACE is no longer enforced
2018-07-30 18:56:56 +02:00
2bb11ef47a
Merge pull request #1021 from akohlmey/spin-package-fixes
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SPIN package fixes, especially for DMI
2018-07-30 10:39:35 -06:00
4a8f2c2d29
Merge pull request #1020 from akohlmey/coverity-inspired-fixes
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Coverity inspired fixes to BODY package
2018-07-30 10:39:08 -06:00
882e1e5138
resolve dependency problem between RIGID and USER-OMP package
2018-07-30 18:32:28 +02:00
b76f86602a
docs: Fix spelling mistakes and clarify Tools.txt
2018-07-30 21:18:59 +05:30
a00d7becc3
emacs: Major readme update and refactor
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Also update the license and switch to GPL v2 like lammps
2018-07-30 20:51:28 +05:30
2c9e96be11
emacs: Stop forcing filename patterns
2018-07-30 19:58:18 +05:30
82fc3b99d9
emacs: Update mode file
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This is a squashed commit including the following changes:
1) Update mode header
2) Clean up white-space
3) Fix free variable warning
4) Add proper file ending stuff
5) Rename to keep conventional naming scheme
6) Updates to the readme
7) Update to conform to `package-lint` criteria
8) Add license header
9) Add in-file instructions
2018-07-30 19:37:01 +05:30
528fc8f6a1
Merge pull request #21 from lammps/master
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rebase
2018-07-29 16:04:36 -05:00
fa9b46fb40
Add BUILD_DOC option to CMake README.md
2018-07-29 00:08:20 -04:00
8fccf6b9b4
Use absolute paths for docenv
2018-07-28 23:31:50 -04:00
99985a1d5b
Add profile.d files to set LAMMPS_POTENTIALS environment variable
2018-07-27 20:31:53 -04:00
6cd7299920
update CODEOWNERS file to automatically notify @julient31 on changes to the SPIN package
2018-07-27 12:10:43 +02:00
28993d9823
Commit JT 072618
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- improvements documentation (dmi and exchange)
- correction error cross product in pair_spin_dmi.cpp
- implementation mech. part in pair_spin_dmi.cpp
- correction in all pairs: init_one for [j][i] couples
- correction in atom_vec_spin.cpp: index error in read_data
- some improvements in pair_spin_dmi.cpp and pair_spin_magelec.cpp
2018-07-27 12:00:15 +02:00
649d0167c8
sorted out restart
2018-07-27 10:41:01 +01:00
2af88dcc26
avoid uninitialized variables
2018-07-27 10:39:01 +02:00
8075b98fc5
initialize rsqinv
2018-07-27 10:24:38 +02:00
f63e2b6eaf
simplify code and guarantee that "mode" is initialized
2018-07-27 10:24:15 +02:00
06335e77cb
Ensure doc is built by default when enabled
2018-07-27 02:56:26 -04:00
9ffd262039
Add CMake target for html documentation
2018-07-27 02:46:36 -04:00
819e47b69e
Add output dir and verbose option to txt2rst
2018-07-27 02:30:28 -04:00
c8b9a727e4
Add potential files to CMake install target
2018-07-27 00:35:08 -04:00
ed96958915
Merge branch 'master' of https://github.com/sergeylishchuk/lammps
2018-07-26 11:56:41 +01:00
a2303e5a15
more changes to ATM source and doc file
2018-07-26 11:54:04 +01:00
7cae80b6d8
Merge https://github.com/lammps/lammps
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more changes to ATM source and doc file
2018-07-26 11:42:53 +01:00
ae0979e1ad
Merge pull request #1017 from lammps/doc-reorg-errors-python
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changes to Errors and Python doc pages
2018-07-25 16:32:46 -06:00
532d09bd56
Correct lammps.book
2018-07-25 16:56:49 -04:00
353ecd2c7a
Correct header levels
2018-07-25 16:56:28 -04:00
e6e026433c
Fix clean-all in docs Makefile
2018-07-25 16:49:51 -04:00
1d9ad55796
changes to Errors and Python doc pages
2018-07-25 14:10:00 -06:00
dff8977156
Merge pull request #1016 from lammps/doc-reorg-examples-modify
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doc changes for Examples and Modify sections
2018-07-25 11:44:54 -06:00
592804d56f
Fix header level of Tools.txt
2018-07-25 11:53:31 -04:00
ee394b0ed1
Fixup header levels
2018-07-25 11:53:17 -04:00
030f1c0127
Update lammps.book
2018-07-25 11:48:57 -04:00
22c9258b8e
doc changes for Examples and Modify sections
2018-07-25 09:27:13 -06:00
0fc789bae5
Merge pull request #1015 from akohlmey/allow-commands-after-exception
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Re-allow commands after an exception was caught inside a run.
2018-07-25 08:43:02 -06:00
8d49d1a8c5
Merge pull request #1010 from lammps/latte-checksum
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new checksum for LATTE download
2018-07-25 08:42:35 -06:00
c31d7c6f45
Merge pull request #1009 from ndtrung81/gpu-maint
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Fixed bugs to the tersoff gpu styles for OpenCL builds and some maintenance
2018-07-25 08:42:04 -06:00
45532b7106
Merge pull request #996 from marshallmcdonnell/fix_tail_in_gcmc
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Fixes #995 : Added tail correction to fix gcmc
2018-07-25 08:41:37 -06:00
