fb03924e83
patch 2Aug18
2018-08-02 11:12:57 -06:00
ad88ecd3ef
Merge pull request #1030 from akohlmey/collected-small-fixes
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Collected small fixes for the next patch release
2018-08-01 10:54:31 -06:00
d598e7c60e
rename preprocessor guard to prevent multiple inclusion to be consistent with file name
2018-08-01 15:54:46 +02:00
42948b60ee
corrections for broken links in the html docs
2018-08-01 14:37:03 +02:00
d877a12e0c
Merge branch 'fix_xrd_histo' of https://github.com/king-michael/lammps into collected-small-fixes
2018-08-01 13:57:56 +02:00
c8be5a3f2d
change ave/histo to ave/histo/weight
2018-08-01 11:11:18 +02:00
77e5445bfe
Need to purge old pair_cdeam.* files
2018-07-31 14:16:54 -04:00
eb967a8a6c
Merge pull request #1027 from akohlmey/move-cdeam
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Move pair style eam/cd from USER-MISC to MANYBODY
2018-07-31 10:39:18 -06:00
2b7b61d5b7
Merge pull request #1023 from amritagos/patch-1
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docs: Fix spelling mistakes and clarify Tools.txt
2018-07-31 10:38:47 -06:00
ff351bd5f7
Merge pull request #1022 from HaoZeke/updateEmacs
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emacs: Update mode file
2018-07-31 10:38:26 -06:00
c6186bf00d
whitespace and formatting update
2018-07-31 17:36:49 +02:00
e9d40d3c6d
rename class from PairCDEAM to PairEAMCD
2018-07-31 17:16:18 +02:00
8c0955aaff
Merge pull request #1025 from lammps/doc-reorg-speed-packages
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changes to Packages and Speed doc files
2018-07-31 08:58:49 -06:00
67e70316de
rename pair_cdeam.* to pair_eam_cd.*
2018-07-31 16:58:44 +02:00
bbaf522430
Merge pull request #1024 from akohlmey/cmake-dependencies-fixups
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Resolve object dependency problems for CMake build system
2018-07-31 08:50:33 -06:00
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
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
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
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
