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e830dd9761
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Merge pull request #14 from akohlmey/kokkospod
Update kokkospod branch to upstream and minor cleanups and corrections
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2024-06-25 00:01:25 -04:00 |
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6ef8472481
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Merge commit 'refs/pull/4168/head' of github.com:lammps/lammps into kokkospod
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2024-06-24 23:52:39 -04:00 |
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6b659a6e56
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Remove commented out code and turn off timing
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2024-06-24 22:48:34 -04:00 |
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ebbb2673f1
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Merge branch 'kokkospod' of https://github.com/cesmix-mit/lammps into kokkospod
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2024-06-24 22:34:52 -04:00 |
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e195f1759f
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Remove unused parameters, change command name, and update documentation and examples..
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2024-06-24 22:32:35 -04:00 |
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eb7c6e47ae
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Merge pull request #15 from stanmoore1/kokkospod
Small changes for https://github.com/lammps/lammps/pull/4168
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2024-06-24 21:26:59 -04:00 |
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a2fcec6aaa
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fix typos, spelling, incorrect markup, and correct and add more details for speedup note
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2024-06-24 20:01:41 -04:00 |
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667c673855
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Update docs
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2024-06-24 17:55:28 -06:00 |
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a88a22c36e
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Small cleanup
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2024-06-24 17:52:58 -06:00 |
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d5e5630cc5
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Comment out unused var
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2024-06-24 17:42:17 -06:00 |
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63f61a41dc
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Update .gitignore for POD
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2024-06-24 17:41:21 -06:00 |
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b9a850d93f
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Add logic for GNU Make
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2024-06-24 17:40:47 -06:00 |
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bf6e0d59c9
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fix bug in general triclinic dump refactor reported by @stanmoore1
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2024-06-24 19:18:49 -04:00 |
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da095a1d79
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minor edits to new pair dpd/coul/slater/long doc page
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2024-06-24 16:36:38 -06:00 |
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9a41f6aedf
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spelling updates
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2024-06-23 04:21:01 -04:00 |
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01a85639f9
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Merge branch 'develop' into kokkospod
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2024-06-23 03:56:39 -04:00 |
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0d1759d4a4
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small programming style updates
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2024-06-23 03:56:23 -04:00 |
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e17dc38087
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use utils::numeric to convert text to numbers
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2024-06-23 03:56:10 -04:00 |
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21685136be
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add braces to group commands according to indentation
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2024-06-23 03:55:50 -04:00 |
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79cc64766b
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initialize all pointers to null, reorder to match definition
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2024-06-23 03:55:10 -04:00 |
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3c81badc5c
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avoid namespace pollutions from defines in eapot.h
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2024-06-23 03:40:04 -04:00 |
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487a9ae73e
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return to alphabetical order
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2024-06-23 03:09:54 -04:00 |
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0e28eb0348
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Make sure CMAKE_INSTALL_FULL_LIBDIR is defined when using it
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2024-06-22 23:28:05 -04:00 |
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fb529bb9e8
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trigger calling Fix::reset_dt() which may cause segfaults with respa
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2024-06-22 20:04:40 -04:00 |
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9dc85dec54
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apply clang-format
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2024-06-22 20:04:09 -04:00 |
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5693c8ac33
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modernize fix instance lookup
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2024-06-22 20:03:14 -04:00 |
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b8cbd1bfc3
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use proper technical term
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2024-06-22 14:26:24 -04:00 |
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090ed81e77
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avoid segfault in fix shake/rattle when timestep is changed before run
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2024-06-22 14:20:23 -04:00 |
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f1c5b4b68d
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avoid access to uninitialized step_respa pointer in Nose-Hoover fixes
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2024-06-22 04:16:46 -04:00 |
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353121c942
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update compute descriptors
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2024-06-21 22:08:20 -04:00 |
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cfcd2b2068
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Merge pull request #4202 from lammps/dump-triclinic-bug-fix
Dump triclinic bug fix
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2024-06-21 14:29:31 -04:00 |
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cf2dede47f
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whitespace
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2024-06-21 12:20:59 -04:00 |
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13f0e37a57
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Merge pull request #4201 from lammps/amoeba-doc-page
Fix errors in fix amoeba/pitorsion doc page
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2024-06-21 12:17:26 -04:00 |
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eba1599f9c
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typo comment change
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2024-06-21 09:35:10 -06:00 |
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de684a15b6
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typo code change
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2024-06-21 09:33:12 -06:00 |
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fc539b46ea
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change all function ptrs and 2 example dump files
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2024-06-21 09:23:04 -06:00 |
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7dae9c05ba
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changes for triclinic function ptr init
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2024-06-21 08:59:09 -06:00 |
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d0da16070b
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one more change
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2024-06-21 08:00:50 -06:00 |
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6b42545044
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fix errors in fix amoeba/pitorsion doc page
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2024-06-21 07:51:49 -06:00 |
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241a8dda63
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Merge pull request #4200 from akohlmey/collected-small-changes
Collected small fixes for development version
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2024-06-21 09:42:57 -04:00 |
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fe13768fa4
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remove unused class member
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2024-06-21 01:16:50 -04:00 |
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c7f386ce9f
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fix missing arguments and cut-n-paste error reported by coverity scan
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2024-06-21 01:13:36 -04:00 |
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a6d51b7cc8
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follow LAMMPS programming style more closely
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2024-06-21 01:04:55 -04:00 |
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41d24f5d57
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apply clang-format
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2024-06-21 01:02:02 -04:00 |
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6d1fb9eb62
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fix typo
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2024-06-20 20:31:24 -04:00 |
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fc98f626b4
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Merge branch 'develop' into collected-small-changes
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2024-06-20 20:13:22 -04:00 |
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7e8f956e05
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remove accidental commit
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2024-06-20 20:09:28 -04:00 |
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8ce284f125
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Merge pull request #4145 from jrgissing/improve_type_label_support
Improve type label support
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2024-06-20 16:30:22 -04:00 |
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dfabe5d333
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Merge remote-tracking branch 'github/develop' into collected-small-changes
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2024-06-20 16:25:43 -04:00 |
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65f2767d9d
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Merge pull request #4169 from ohenrich/cg-dna
CG-DNA: Real units and potential reader
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2024-06-20 16:25:16 -04:00 |
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