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e76c8bbaa3
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spelling
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2022-01-28 14:52:31 -05:00 |
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4225c6c288
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whitespace
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2022-01-28 14:48:34 -05:00 |
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d6a6f64576
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Merge pull request #3090 from rbberger/modernize_use_override
Modernize to C++11: use override
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2022-01-28 14:10:45 -05:00 |
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17cb137f3e
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Merge branch 'master' into OptimizedDynamicalMatrix
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2022-01-28 11:08:31 -08:00 |
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e4fe0a37a1
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fixed ewald self-energy update and updated documentation
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2022-01-27 16:48:22 -06:00 |
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d51017ff50
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Merge pull request #3095 from akohlmey/collect-small-changes
Collected small changes and fixes
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2022-01-26 12:04:44 -05:00 |
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0b693e729d
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Whitespace
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2022-01-24 17:33:36 -07:00 |
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c914fc6baf
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Small doc tweak
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2022-01-24 16:33:11 -07:00 |
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67af170929
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Sorting is not required for balancing
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2022-01-24 16:22:55 -07:00 |
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aeb25b5a37
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Tweak docs
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2022-01-24 15:28:40 -07:00 |
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1d60e4c463
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Add docs
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2022-01-24 15:16:49 -07:00 |
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7aed8954a5
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Add paragraphs in Modify_style.rst
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2022-01-22 11:03:44 -05:00 |
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3311b1344c
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consolidate pair-wise vs pairwise spelling
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2022-01-21 10:48:35 -05:00 |
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3a6bd2e698
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update comment about pair_write restrictions
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2022-01-21 10:47:49 -05:00 |
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1e7969c7b9
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add new pair styles harmonic/cut and harmonic/cut/omp
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2022-01-15 19:34:47 -05:00 |
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e3dd2908d9
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Step version strings for the next patch release
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2022-01-06 19:42:45 -05:00 |
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1f924e9fc1
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Merge pull request #3071 from akohlmey/collected-small-changes
Collected small changes and bug fixes
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2022-01-06 19:22:30 -05:00 |
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8e0622d523
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Merge pull request #3046 from donatas-surblys/centroid-stress-constraint-rigid
Centroid atomic stress for shake, rattle and rigid/small
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2022-01-05 12:36:27 -05:00 |
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e5416a9fee
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update documentation for new centroid stress for shake and rigid/small
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2022-01-05 19:02:25 +09:00 |
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8439f87b76
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make consistent with other reference
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2022-01-03 18:26:56 -05:00 |
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de404d1ed8
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Merge branch 'update_doc_file' of github.com:jddietz/lammps into collected-small-changes
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2022-01-03 18:26:01 -05:00 |
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a9a568aefa
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Updated references for pair_nm.rst
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2022-01-03 11:50:04 -10:00 |
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90726ca088
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explain that the computed force in python pair is force/r same as in Pair:single()
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2022-01-03 10:12:51 -05:00 |
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f3c5593c50
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correct code example
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2022-01-01 16:40:54 -05:00 |
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cf9429dc68
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implement overloads so that utils::*numeric() functions can be safely used with std::string()
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2021-12-30 11:03:37 -05:00 |
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b39d1993bb
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Merge pull request #3052 from lammps/time-dumps2
Time-dependent dumps for variable timestep (alternate implementation)
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2021-12-23 16:34:12 -05:00 |
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6af36075ba
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Merge pull request #3064 from rbberger/collected-small-changes
Collected small changes and fixes
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2021-12-23 16:13:35 -05:00 |
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23f1c9de60
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Merge branch 'develop' into time-dumps2
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2021-12-23 14:29:04 -05:00 |
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3748a14582
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warn about problems with the MPIIO package
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2021-12-23 01:59:45 -05:00 |
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09944f5d7a
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Merge pull request #2996 from stanmoore1/compute_phase
Add compute ave/sphere/atom
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2021-12-22 21:16:25 -05:00 |
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8f62cd79f4
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add missing list entry
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2021-12-22 19:55:06 -05:00 |
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cde7dd34fd
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Doc update
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2021-12-21 16:46:53 -07:00 |
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1bbf45784b
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Rename and relocate
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2021-12-21 16:29:11 -07:00 |
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5932a3f6f9
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Merge branch 'develop' of github.com:lammps/lammps into big_dump_sort
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2021-12-21 12:58:24 -07:00 |
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8ed35832f4
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Merge branch 'develop' into time-dumps2
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2021-12-21 14:16:23 -05:00 |
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e06222099a
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Small tweak to docs
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2021-12-21 11:51:30 -07:00 |
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ded48cc031
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more optimizations and extend to other dump styles
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2021-12-21 10:57:42 -07:00 |
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2533abb266
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Add doc page
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2021-12-21 10:46:23 -07:00 |
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97b5651633
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minor correction to angle class2
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2021-12-20 10:33:05 -07:00 |
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40c0925cb4
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Updated and added third order kokkos
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2021-12-14 14:25:49 -08:00 |
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b3fcda3214
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Merge pull request #3057 from akohlmey/next_patch_release
Step version strings for the next patch release
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2021-12-14 17:08:29 -05:00 |
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4be0e0a4e5
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Merge branch 'develop' of https://github.com/lammps/lammps into big_dump_sort
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2021-12-14 08:00:14 -07:00 |
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62cdf7ab2d
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update docs
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2021-12-14 09:13:05 -05:00 |
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ccdb939a40
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Merge pull request #3054 from nw13slx/rerun_bin
Support binary native dump files with read_dump and rerun
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2021-12-13 19:22:00 -05:00 |
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2b85799729
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Updating MISC to EXTRA-X in doc files
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2021-12-13 12:27:00 -07:00 |
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94ac1ad4a0
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update version strings for the next patch release
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2021-12-13 11:56:44 -05:00 |
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94d5c75fdf
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small updates for docs and comments
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2021-12-12 18:11:33 -05:00 |
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913b1536d4
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whitespace
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2021-12-11 21:18:33 -05:00 |
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86b696c78c
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Merge branch 'develop' into rerun_bin
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2021-12-11 20:31:48 -05:00 |
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d59458fa37
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clean up commands and documentation
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2021-12-11 17:24:27 -05:00 |
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