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1aeecfb0cf
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Resolved Conflicts:
# doc/Manual.txt
# doc/pair_reax.html
# src/USER-PHONON/fix_phonon.cpp
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2015-12-16 07:31:09 -05:00 |
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074d5962c8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14367 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-12-15 15:59:11 +00:00 |
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5f802f86b5
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14366 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-12-15 15:59:01 +00:00 |
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b1df2f7705
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update webpages for recent changes and newly supported distributions
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2015-11-23 16:35:13 -05:00 |
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d7e8881d15
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
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2015-11-20 06:52:38 -05:00 |
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b857237fef
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14269 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-11-19 15:34:38 +00:00 |
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d30955e5b3
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Determine vendor and release more reliably for newer Fedora releases
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2015-11-03 17:31:32 -05:00 |
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1e9a4cc4b8
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Resolved Conflicts:
# doc/Manual.html
# doc/Manual.txt
# src/REAX/fix_reax_bonds.cpp
# src/REAX/fix_reax_bonds.h
# src/REAX/pair_reax.cpp
# src/USER-MGPT/pair_mgpt.cpp
# src/USER-SMTBQ/pair_smtbq.cpp
# src/lammps.cpp
# src/timer.cpp
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2015-10-31 10:54:08 -04:00 |
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0aa77408f8
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14219 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-30 19:46:30 +00:00 |
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01e0beda67
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14218 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-10-30 19:44:45 +00:00 |
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3bbba19e85
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correct bug in cleanup script and update permissions accordingly
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2015-10-27 07:07:38 -04:00 |
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f634a5e140
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remove executable flag from makefiles
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2015-10-26 22:41:04 -04:00 |
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86948924ca
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rephrase msi2lmp force field error message
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2015-10-24 01:20:32 -04:00 |
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97cd8b401e
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update reference data for current version of msi2lmp and LAMMPS
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2015-10-24 01:15:47 -04:00 |
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adfaeadf63
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add opls-aa test with decane molecules
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2015-10-24 00:55:02 -04:00 |
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104d5890b2
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step version number and document changes
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2015-10-24 00:53:06 -04:00 |
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94618089ad
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add CT-CT-CT-CT torsion parameter to the OPLS/AA force field file
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2015-10-23 23:31:55 -04:00 |
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f19a7fa99c
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update RPM build instructions and spec file for Fedora 23
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2015-10-16 15:27:29 -04:00 |
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8ccb8bfd66
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Resolved Conflicts:
# doc/Manual.html
# doc/Manual.txt
# doc/variable.txt
# src/reader_xyz.cpp
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2015-09-25 09:52:07 -04:00 |
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2ed7d366a6
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14057 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-09-24 20:16:09 +00:00 |
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37ed9409a7
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do not build pre-compiled packages with hdf5 support for now
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2015-08-28 14:50:11 -04:00 |
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e5f316ecf1
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
# doc/Section_start.txt
# doc/dump_h5md.html
# doc/dump_h5md.txt
# doc/package.txt
# src/COMPRESS/dump_atom_gz.cpp
# src/Makefile
# src/USER-H5MD/README
# src/pair.cpp
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2015-08-20 07:42:31 -04:00 |
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16eed7a053
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13902 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-19 14:39:33 +00:00 |
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7be9bc38a2
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13900 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-19 14:33:40 +00:00 |
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650bc50f5c
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
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2015-08-15 06:53:54 -04:00 |
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24bf97204b
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13881 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-14 14:56:57 +00:00 |
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5107280519
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
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2015-08-06 00:51:11 -04:00 |
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d7e358c359
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13833 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-04 20:56:54 +00:00 |
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b0dec93ffb
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13826 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-04 18:54:11 +00:00 |
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57ed470003
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13825 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-08-04 18:48:13 +00:00 |
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6c8830b828
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
# Conflicts:
# doc/Manual.html
# doc/Manual.txt
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2015-07-28 13:26:45 -04:00 |
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d58afbcc48
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13730 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-07-27 14:58:04 +00:00 |
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6cb173f5db
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tweaks for memory info on windws and cross compilation
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2015-07-16 17:20:16 -04:00 |
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b0f70de6f5
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update handling of PATH environment to no longer kill it if too long
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2015-06-27 15:22:07 -04:00 |
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cfdc159e39
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where did the intel package examples go?
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2015-06-16 16:25:01 -04:00 |
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4e8b188ad0
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there are no intel examples anymore which breaks cross-compilation
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2015-06-16 15:19:50 -04:00 |
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927ba9de2a
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Merge remote-tracking branch 'lammps-ro/master' into lammps-icms
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2015-04-15 21:51:32 -04:00 |
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dce226f164
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git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13410 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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2015-04-14 14:18:40 +00:00 |
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4741a42cfe
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without kokkos we do not need hwloc
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2015-04-08 18:01:11 -04:00 |
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fe18b8739d
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revert handling of the kokkos package completely
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2015-04-08 17:19:23 -04:00 |
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33e8964da4
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new attempt to fully disable kokkos for now
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2015-04-08 16:59:40 -04:00 |
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cbfba847b4
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KOKKOS is still considered too experimental for production builds
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2015-04-07 18:19:38 -04:00 |
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574c6f0137
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RPM specfile macro magic to select when we can try to include KOKKOS
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2015-04-07 16:22:02 -04:00 |
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45b258605c
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compile KOKKOS package into lammps for windows.
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2015-04-07 15:30:51 -04:00 |
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9b6d8caf43
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include high-precision timers for KOKKOS
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2015-04-07 05:25:16 -04:00 |
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09469dd934
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allow including the OpenMP version of the KOKKOS package
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2015-04-06 21:42:54 -04:00 |
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69aacfb451
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update scripts and information for building pre-compiled packages
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2015-03-18 15:14:53 -04:00 |
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96b60c7aea
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adjust spec file for building rpms to handle new master makefile
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2015-03-13 14:36:21 -04:00 |
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0c8505ac3b
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exclude new USER-QUIP package from build process due to external lib
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2015-02-25 17:22:02 -05:00 |
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31b8f8606c
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update for OpenSuSE 13.2
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2015-02-04 15:04:49 -05:00 |
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