58559d9e62
update src/.gitignor for SPIN package sources
2018-06-27 14:08:54 -04:00
3eed23d3f7
whitespace cleanup
2018-06-27 14:07:09 -04:00
d3b83885d1
make SPIN package examples consistent with other examples and add reference logs
2018-06-27 14:06:56 -04:00
3549345830
whitespace cleanup
2018-06-27 12:30:19 -04:00
244963aa19
fix incorrect scaling of emag bug
2018-06-27 12:29:34 -04:00
264f832b18
fix formatting of dump_modify docs
2018-06-27 07:58:57 -04:00
5c4bf8ac47
bond/react: optional EdgeIDs take2
2018-06-26 20:40:02 -06:00
6008cee6aa
...and replace with symbolic links
2018-06-26 16:02:56 -04:00
f33a2c982c
remove redundant potential files
2018-06-26 16:01:54 -04:00
8e14143908
Merge pull request #925 from PabloPiaggi/pair_entropy
...
Pair entropy fingerprint
2018-06-26 13:16:09 -06:00
e6ef8ce5ee
Merge pull request #968 from oywg11/github-tutorial-update
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New paramteters for potential #839
2018-06-26 13:14:22 -06:00
ebe622ff7d
make edge atoms optional
2018-06-26 09:35:38 -06:00
f94cdf856c
Merge pull request #18 from lammps/master
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rebase
2018-06-26 10:15:52 -05:00
e2622f0230
Remap the paragraph
2018-06-26 17:27:55 +03:00
e4dd6dec40
Refine the documentation
2018-06-26 16:36:16 +03:00
b0126dd9d6
updata potential file CH.KC
2018-06-26 16:09:42 +03:00
f36e1a2cdc
Changed default deltabin from 2 to 3
2018-06-26 13:06:04 +02:00
c9d147c366
New paramteters for potential #839
2018-06-26 11:09:48 +03:00
19f81e0802
Add library functions for accessing LAMMPS configuration
2018-06-25 23:56:18 -04:00
49a91db0b2
small changes to last LATTE PR, including xControl to upper case
2018-06-25 17:43:31 -06:00
bad750eb2b
move LATTE ABI version constant into a define at the top of fix latte, as suggested by @sjplimp
2018-06-25 19:34:10 -04:00
5e48565761
Merge pull request #961 from cnegre/newsystem
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Added newsystem flag to be passed to latte
2018-06-25 17:20:57 -06:00
af91f7fa5d
LAMMPS does not build on windows without this one
2018-06-25 18:13:41 -04:00
0cd86bab22
Added new checksum value
2018-06-25 14:58:49 -06:00
bec82e4045
Added new checksum value
2018-06-25 14:23:44 -06:00
06b3209ad8
Commit JT 062518
2018-06-25 09:56:39 -06:00
2fd45050cd
Merge branch 'newsystem' of https://github.com/cnegre/lammps into newsystem
2018-06-25 08:44:57 -06:00
8ffa96c9e9
Added fix latte
2018-06-25 08:43:00 -06:00
6a9251245c
update MD5 sum for latte-v1.2.0.tar.gz src archive
2018-06-25 09:43:37 -04:00
cb2cf5b773
cmake: fixed comment
2018-06-25 06:31:09 -06:00
c4d0994d5e
cmake: fixed a typo
2018-06-25 06:29:24 -06:00
e2c03f0596
Simplify build system conflict checks
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- removes redundant code for conflict checks
- updates and expands original check to report fatal error instead of ignoring
files
- removes obsolete DetectAndRemovePackageHeader and RemovePackageHeader utility
functions which are no longer needed
- adds utility function DetectBuildSystemConflict, which loops over files and
reports an error if they exist in the lammps src directory.
- updates definition of LAMMPS_SOURCE_DIR, LAMMPS_LIB_SOURCE_DIR and
LAMMPS_LIB_BINARY_DIR to be absolute paths. This improves instructions in
error messages
2018-06-25 03:09:42 -04:00
9108306c11
Shorter entropy/atom example
2018-06-24 00:36:09 +02:00
86519ce213
Rename compute to entropy/atom
2018-06-24 00:25:07 +02:00
0b1d4a1696
liblammps.pc: fix lib suffix
2018-06-22 17:06:39 -06:00
264e4fd3b1
cmake: fix for <cmake-3.4
2018-06-22 17:05:55 -06:00
d237625d2a
patch 22Jun18
2018-06-22 14:08:09 -06:00
ce0f3daad6
cmake: don't include quiet packages in summary
2018-06-22 11:43:52 -06:00
cb7b23e220
cmake: add BUILD_EXE option
2018-06-22 11:11:09 -06:00
3f17d33fbe
cmake: add BUILD_LIB option
2018-06-22 11:06:12 -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
2165a2aa9b
Changed version on cmakelist and install.py
2018-06-22 10:04:20 -06:00
ac41cc2c9a
cmake: add GPU_PREC status output
2018-06-22 09:02:10 -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
35f5a685f6
small change to preempt a possible merge conflict
2018-06-22 08:19:49 -04:00
62984c1de0
small tweaks: improve messages and comments
2018-06-22 08:02:17 -04:00
04d040b863
update make purge list and fix checking for styles and installed package files in cmake
2018-06-22 07:57:03 -04:00
92f0f19df6
make info config output of compile time defines consistent with lmp_<machine> -h
2018-06-22 07:26:33 -04:00
dcdc7877a4
make compile time output more consistent and complete
2018-06-22 07:05:09 -04:00
2f11f2d7b2
query compile time settings in Info class
2018-06-22 06:59:09 -04:00
