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08ac695a06
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move include statements from headers to implementation files where possible in USER-REAXC
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2019-06-27 01:03:08 -04:00 |
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17602b4c26
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some more include file cleanup.
include cstdlib where functions like atoi() are used
remove unneeded include statements from headers
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2019-06-27 01:02:17 -04:00 |
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f7507512b1
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apply memory alignment settings from my_page.h to my_pool_chunk.h
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2019-06-27 00:39:47 -04:00 |
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ff36bad099
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cleanup includes in variable.h
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2019-06-27 00:33:48 -04:00 |
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7f342b1cd0
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Merge pull request #1539 from junghans/fix_include_for_ppc64le
add missing include needed on ppc64le
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2019-06-27 00:26:33 -04:00 |
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8c3d18520d
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add missing include needed on ppc64le
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2019-06-26 10:45:31 -06:00 |
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8fd1aaba7e
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Merge pull request #1535 from evoyiatzis/class2
Implementation of inner/middle/outer compute methods for lj/class2/coul/long
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2019-06-25 06:00:06 -04:00 |
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50e76ff7a1
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restore virtual keyword and empty lines in comments
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2019-06-25 05:59:29 -04:00 |
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423eebda25
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restore header
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2019-06-25 05:57:48 -04:00 |
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f6842e643e
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Merge pull request #1525 from akohlmey/collected-small-changes
Collected small changes and fixes for the next patch
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2019-06-24 23:55:50 -04:00 |
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5f7c4fb668
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Merge pull request #1534 from uihsnv/archlinux_pkg
Archlinux install documentation
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2019-06-24 23:55:09 -04:00 |
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a36d2573cf
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make certain, we are not mixing cutoff and long-range coulomb when looking cutoffs
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2019-06-24 09:10:00 -04:00 |
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8b49cac86a
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correct dimensionality of cut_coul property in Pair::extract()
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2019-06-24 09:09:22 -04:00 |
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2159a8c44a
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Arch specific words
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2019-06-24 16:14:29 +05:30 |
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3e93881e44
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store compute_tally array in restart and read it back. fix memory leak.
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2019-06-24 05:28:54 -04:00 |
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171d74f2f2
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remove class member name clashes. Pointers contains infile so we rename other uses to inpfile
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2019-06-23 16:43:54 -04:00 |
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f31faafeec
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modification in the doc file of lj/class2 style
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2019-06-23 20:18:39 +02:00 |
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3b6cc29f64
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Implementation of inner/middle/outer compute methods for lj/class2/coul/long
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2019-06-23 20:16:25 +02:00 |
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58f9380c45
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Archlinux install documentation
Link to #1495
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2019-06-22 19:46:21 +05:30 |
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f190647ab4
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use snprintf() instead of sprintf() to avoid buffer overflows when copying style names
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2019-06-21 21:23:20 -04:00 |
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7a56a4be24
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add option to pair_modify to explicitly turn off F dot r
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2019-06-21 14:18:18 -04:00 |
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c79044c361
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Merge pull request #1531 from athomps/snap-yarray-tweak
Added NULL initialization for snaptr
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2019-06-21 10:38:43 -04:00 |
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c460d05bc6
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Added NULL initialization for snaptr
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2019-06-21 00:26:44 -06:00 |
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a01421db99
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Merge branch 'master' into collected-small-changes
# Conflicts:
# doc/src/pair_spin_dipole.txt
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2019-06-20 14:38:51 -04:00 |
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f1034e982d
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Merge pull request #1530 from eagunn/iss1526
Minor cleanup for doc/src
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2019-06-20 13:23:21 -04:00 |
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6760866f44
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integrate pair styles spin/dipole/cut and spin/dipole/long properly into docs
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2019-06-20 11:49:53 -04:00 |
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17bfed3590
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move non-LaTeX images from doc/src/Eqs folder to doc/src/JPG
this also updates links in doc sources referencing them
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2019-06-20 11:39:41 -04:00 |
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bc224bc66e
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Eliminate a doc build warning. pair_spin_dipole.txt was recently edited. Much content was removed and it no longer contained any internal reference links. But it still had a link anchor at the bottom. This was generating a build warning. I've removed the unused link anchor and an unneeded line separator.
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2019-06-20 09:15:40 -06:00 |
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c9fc83ef6f
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Move two non-equation images from Eqs folder to JPG folder
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2019-06-20 08:16:20 -06:00 |
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f54ad09668
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recreate missing LaTeX files for image-only equations
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2019-06-19 17:53:40 -04:00 |
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599ef78161
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put dump_modify after the list of all dump variant doc pages
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2019-06-19 17:13:06 -04:00 |
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f8f8e441b9
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add missing cmake package module
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2019-06-19 07:06:54 -04:00 |
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bb11344424
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Merge pull request #1522 from akohlmey/next_version
Step version string for next patch release
patch_18Jun2019
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2019-06-18 22:01:42 -04:00 |
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e754fb80a4
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Merge pull request #1518 from akohlmey/collected-small-changes
Collected small changes and fixes for the next patch release
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2019-06-18 16:21:41 -04:00 |
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98fbaef406
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workaround for ICE issue with gcc 4.8.x
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2019-06-18 15:00:27 -04:00 |
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d98c105d34
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step version string to 18 June 2019
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2019-06-18 11:52:09 -04:00 |
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961dcfc261
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mention alternate build environment generators for cmake
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2019-06-18 11:50:06 -04:00 |
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81cdce9b04
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flag and document that USER-TALLY computes are not compatible with dynamic groups
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2019-06-18 00:14:48 -04:00 |
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995b6b31a2
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flag a couple more packages that contain sub-builds of downloaded code
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2019-06-17 16:05:54 -04:00 |
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e9666f585f
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update log files for kolmogorov/crespi/full potential
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2019-06-17 15:46:54 -04:00 |
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f4f4a7c850
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adapt for Ninja build tool, which cannot handle sub-builds and fortran
so builds of downloaded libraries are not supported right now
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2019-06-17 14:24:51 -04:00 |
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5fc3081a55
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make building tools (msi2lmp, chain.x) an option, which is off by default
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2019-06-17 14:23:30 -04:00 |
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a39a35af20
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Merge pull request #1517 from jrgissing/bond/react-clarify-template-check-messages
Bond/react: clarify reaction-template warning messages
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2019-06-17 14:14:53 -04:00 |
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1452d3d25b
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Merge pull request #1516 from gtribello/master
Using PLUMED to compute committor with LAMMPS
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2019-06-17 14:14:37 -04:00 |
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2dea4eb0e9
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Merge pull request #1513 from akohlmey/user-tally-vs-hybrid
Make USER-TALLY compute styles compatible with hybrid pair styles
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2019-06-17 14:14:06 -04:00 |
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5d73b0790f
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Merge pull request #1510 from evoyiatzis/respa_class_2
Implementation of inner/middle/outer compute methods for lj/class2
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2019-06-17 14:13:47 -04:00 |
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93fd33aad9
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Merge pull request #1507 from athomps/yarray
Back-porting of Zombie SNAP improvements
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2019-06-17 14:13:28 -04:00 |
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6536399fc3
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Merge pull request #1476 from uihsnv/log_spacing
A function logfreq3(), for logarithmic spacing
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2019-06-17 14:12:59 -04:00 |
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2f29bd29f4
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Merge pull request #1430 from ndtrung81/gpu-neigh-hybrid
Enable neighbor build on the device for pair hybrid substyles
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2019-06-17 14:12:40 -04:00 |
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b1458ceebf
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fix typo
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2019-06-17 07:42:18 -04:00 |
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