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2e6b975878
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update version tag placeholders for added, removed, or changed functionality
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2022-12-19 22:11:06 -05:00 |
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8998ef23de
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update docs for tools/tabulate scripts
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2022-12-16 02:49:39 -05:00 |
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3a95a7b973
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add utility to detect pending version tags in .. versionadded/changed::
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2022-09-25 03:51:54 -04:00 |
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b37c145352
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convert URLs to https where possible, check URLs for bit rot and update or remove
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2022-09-24 08:02:18 -04:00 |
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caa80ef344
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use upper case LAMMPS as the name of the package consistently
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2022-09-24 03:45:23 -04:00 |
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55fdb7f12a
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update GPU container definitions for CUDA 11.7 and singularity -> apptainer
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2022-06-08 08:19:54 -04:00 |
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60b9fd2db8
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minor tweaks simplify algorithm
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2022-05-07 17:08:22 -04:00 |
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6722d3fb00
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add simple STL binary to ASCII converter (based on Wikipedia specs)
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2022-05-07 16:26:25 -04:00 |
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4d1bdb4741
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add python tool to detect and remove (if desired) error docs from headers
also document the tools in the manual.
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2022-04-23 13:52:12 -04:00 |
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d85788305d
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update manual
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2022-02-12 10:37:09 -05:00 |
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60d03f34cc
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update create.f with changes from NIST database
also add parameters for Cr and document in README file and change
the code to create output files with .eam.alloy extension
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2022-02-10 14:41:25 -05:00 |
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5ff881fb0d
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Change "offsite" to "external" to correct broken URLs to lammps.org
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2021-09-20 12:05:52 -04:00 |
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4846d8283e
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convert chain.f to fortran 90+ style free format file chain.f90
this is to maintain compatibility with some newer fortran compilers
that do not support legacy style fortran by default anymore.
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2021-08-25 18:38:08 -04:00 |
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2d488bab6b
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Merge branch 'master' into collected-small-changes
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2021-07-27 11:15:00 -04:00 |
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7e6a06b1cc
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update Pizza.py URLs
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2021-07-25 21:04:26 -04:00 |
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5a79429f03
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fix up some more package designations and clean up some legacy formatting
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2021-07-25 20:23:37 -04:00 |
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f8f4af471f
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general rename of files, styles, and keywords from "reax/c", "reax", or "reaxc" to "reaxff"
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2021-07-21 21:52:25 -04:00 |
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cc0d9f2be0
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recover building the manual
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2021-06-29 21:49:21 -04:00 |
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878795e64a
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bulk rename of remaining USER- packages
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2021-06-29 20:12:59 -04:00 |
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c085e55695
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rename USER-SMD package to MACHDYN
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2021-06-29 17:19:39 -04:00 |
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9cb82f4033
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update docs for renames examples folders
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2021-06-29 11:31:57 -04:00 |
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09c19a936b
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update URLs in source code and manual
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2021-05-24 14:18:20 -04:00 |
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13fb03cf2c
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fix typo
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2021-05-05 23:22:05 -04:00 |
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bdbe773a08
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add documentation for offline building scripts
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2021-05-05 23:20:01 -04:00 |
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1b409fbae8
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update docs for magic patterns
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2021-03-14 06:39:59 -04:00 |
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84b0da3054
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add a "magic" file for use with the file(1) command to detect LAMMPS files
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2021-03-14 05:44:28 -04:00 |
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74fe20b9a9
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Update affiliations
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2021-02-15 15:05:40 +01:00 |
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a8c0142621
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update docs for building SWIG Tcl wrapper
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2020-10-20 21:22:39 -04:00 |
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faf67662d5
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fix typo
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2020-10-20 16:47:56 -04:00 |
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b9a57899a6
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whitespace fix
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2020-10-20 16:46:21 -04:00 |
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eeaff55df7
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SWIG support documentation update
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2020-10-20 16:37:30 -04:00 |
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cd444eefe2
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Merge branch 'master' into swig-wrappers
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2020-10-19 21:58:23 -04:00 |
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f74203fb33
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start adding documentation about SWIG wrapping to the manual
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2020-10-19 01:00:02 -04:00 |
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722b9c8cf3
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small tweak
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2020-10-16 22:46:33 -04:00 |
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bdb4334210
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add tip about using history as starting point for a new input
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2020-10-11 16:13:13 -04:00 |
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ee98ecc7bb
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document save_history command and a few more small tweaks
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2020-10-11 15:47:38 -04:00 |
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9950f0d259
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small LAMMPS shell updates
- implement a "source" command (same as "include")
- synchronize documentation in manual and README
- updates to readline customizations
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2020-10-11 13:53:15 -04:00 |
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f63ff4cdc9
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LAMMPS shell customization info and some usage tips
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2020-10-11 12:00:16 -04:00 |
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c0f58243cb
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use correct header levels for LAMMPS shell docs
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2020-10-10 23:40:34 -04:00 |
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188e1c3828
|
correct versionadded dates
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2020-10-09 07:22:16 -04:00 |
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ac6e99ae81
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implement "mem" command into LAMMPS shell to print current and max memory use
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2020-10-07 18:36:43 -04:00 |
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5fa1cd7e86
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small corrections
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2020-10-07 05:33:55 -04:00 |
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15f9987c32
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add custom commands "cd" and "pwd" to the LAMMPS shell
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2020-10-06 18:39:22 -04:00 |
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f3b33ea0c6
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address spelling issues
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2020-10-04 14:10:35 -04:00 |
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ffcd905bf1
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complete LAMMPS shell docs interation. Warn if exceptions are missing but don't fail
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2020-10-04 14:03:34 -04:00 |
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b11b420b08
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small doc update for singularity
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2020-09-26 22:30:05 -04:00 |
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e8e57b0628
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remove doxygen tool folder and references to it in the input as it is no longer compatible and needed
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2020-08-30 19:59:52 -04:00 |
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6f6855e831
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do not advertise multiple targets in cmbuild wrapper
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2020-03-17 15:57:33 -04:00 |
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5779731da3
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provide cmbuild wrapper script for cmake. document it and add some improvements to CMake build docs
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2020-03-17 13:04:38 -04:00 |
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cdec46ba6a
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Some more code-blocks instead of parsed-literal
|
2020-03-13 18:38:47 -04:00 |
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