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History Graph
| Commit | Author | Details | Committed | ||||
|---|---|---|---|---|---|---|---|
| e368acdaeb22 | Steve Plimpton/GitHub | Merge pull request #700 from giacomofiorin/colvars-fix | Oct 19 2017 | ||||
| 6e7504f15328 | Giacomo Fiorin | Import segfault fix in Colvars module | Oct 19 2017 | ||||
| 40147a7a64f7 | Steve Plimpton/GitHub | Merge pull request #699 from lammps/doc-update2 | Oct 19 2017 | ||||
| f709a723cd97 | Steve Plimpton | cross ref fix deform and new fix nvt/uef | Oct 18 2017 | ||||
| 6dd55e49cbc4 | Steve Plimpton/GitHub | Merge pull request #698 from lammps/doc-update | Oct 18 2017 | ||||
| 281b1dc37571 | Steve Plimpton | small updates to recently added docs and rename of an example dir | Oct 18 2017 | ||||
| e93f8f888975 | Steve Plimpton/GitHub | Merge pull request #671 from danicholson/user-uef | Oct 18 2017 | ||||
| 35f2cfa0bfaf | Steve Plimpton/GitHub | Merge pull request #669 from urpedersen/master | Oct 18 2017 | ||||
| e44196c01133 | Steve Plimpton/GitHub | Merge pull request #694 from akohlmey/bond-gromos | Oct 18 2017 | ||||
| 2fe1d1b90451 | Steve Plimpton/GitHub | Merge pull request #697 from andeplane/fix_heat_bug | Oct 18 2017 | ||||
| b1b4a52b14e2 | Steve Plimpton/GitHub | Merge pull request #695 from timattox/USER-DPD_small_updates | Oct 18 2017 | ||||
| 382de5034188 | Steve Plimpton/GitHub | Merge pull request #696 from wmbrownIntel/intel-update-oct17 | Oct 18 2017 | ||||
| 7dfc6b7eab71 | Steve Plimpton/GitHub | Merge pull request #688 from lammps/history | Oct 18 2017 | ||||
| 19eb5d389778 | Anders Hafreager | Avoid checking region when not specified | Oct 18 2017 | ||||
| 17c17ac40996 | Axel Kohlmeyer | update multi-threaded neighbor list build for neighbor list refactor | Oct 18 2017 | ||||
| 39ededd46cf7 | Axel Kohlmeyer | update respa/omp integrator style for neighbor list refactor | Oct 18 2017 | ||||
| 2c7528811d7f | Axel Kohlmeyer | update several pair styles to be compliant with refactored respa lists data… | Oct 18 2017 | ||||
| 0966e14e73a7 | Steve Plimpton | more changes to rRESPA neighbor lists | Oct 18 2017 | ||||
| bb141aaae04f | Michael Brown | USER-INTEL: Bug fix for case where a bond/angle/dihedral/improper style is… | Oct 17 2017 | ||||
| 374d619769c2 | Axel Kohlmeyer | add gromos bond style | Oct 16 2017 | ||||
| 59de1a71c8cd | Axel Kohlmeyer | Merge branch 'history' of github.com:lammps/lammps into history | Oct 16 2017 | ||||
| 4c6779cb0d61 | Tim Mattox | USER-DPD Kokkos: propagate the new neigh_modify options from efaa4c67 | Oct 16 2017 | ||||
| 5fb5f70ec684 | Axel Kohlmeyer | update USER-OMP code for shear history neighbor refactoring | Oct 16 2017 | ||||
| b0bba1976b33 | Tim Mattox | USER-DPD: remove unused coord2bin() variants, and add ISFINITE checks | Oct 16 2017 | ||||
| f8f13d929fad | Steve Plimpton/GitHub | Merge pull request #693 from giacomofiorin/colvars-update | Oct 14 2017 | ||||
| 3e89b270fdf8 | Giacomo Fiorin | Update Colvars to version 2017-10-11 | Oct 13 2017 | ||||
| f6ddc8c7c9ba | Stan Moore | Fix compile errors from neigh history refactor | Oct 13 2017 | ||||
| a973c65d67cf | Steve Plimpton/GitHub | Merge pull request #691 from akohlmey/collected-fixes | Oct 13 2017 | ||||
| 1a200588bd4b | Steve Plimpton/GitHub | Merge pull request #689 from rbberger/pylammps_autocomplete_fix | Oct 13 2017 | ||||
| 18ca2292c28f | Steve Plimpton/GitHub | Merge pull request #686 from giacomofiorin/lepton-library | Oct 13 2017 | ||||
| d3ef4bd59414 | Steve Plimpton/GitHub | Merge pull request #685 from ellio167/kim-api-v1.9.2 | Oct 13 2017 | ||||
| 3df9caf43533 | Axel Kohlmeyer | drop const qualifier to allow bracketing of lookup index | Oct 13 2017 | ||||
| fa2e5ac2d902 | Axel Kohlmeyer | handle lookup exceptions consistently across energy and energy+force lookup in… | Oct 13 2017 | ||||
| b7c749260885 | Axel Kohlmeyer | handle invalid lookup for bond/angle tabulation | Oct 13 2017 | ||||
| cee94da85e16 | Axel Kohlmeyer | bugfix. avoiding operating on uninitialize data. closes #690 | Oct 13 2017 | ||||
| 45aa7de171dd | Richard Berger | Limit IPython autocomplete to known commands and properties | Oct 12 2017 | ||||
| 53aa92cfafd1 | Axel Kohlmeyer | add support for neighbor list history refactoring in USER-OMP part 2 | Oct 11 2017 | ||||
| 7e35042c42e9 | Axel Kohlmeyer | add support for neighbor list history refactoring in USER-OMP part 1 | Oct 11 2017 | ||||
| 01051e4cb13c | Steve Plimpton | refactoring of neighbor history | Oct 11 2017 | ||||
| d90aad887eb6 | Giacomo Fiorin | Add Lepton library within lib/colvars | Oct 9 2017 | ||||
| 775a15b9da58 | Ryan S. Elliott | Update lib/kim for kim-api-v1.9.2 | Oct 9 2017 | ||||
| 93c9a9274319 | Steve Plimpton/GitHub | Merge pull request #684 from irisTa56/bugfix-in-domain.cpp | Oct 9 2017 | ||||
| 14dc1c698c60 | Steve Plimpton/GitHub | Merge pull request #683 from wmbrownIntel/pppm_intel_fix | Oct 9 2017 | ||||
| a1f5693fe08e | Steve Plimpton/GitHub | Merge pull request #681 from lammps/dump-modify | Oct 9 2017 | ||||
| 534b7adde4b3 | irisTa56 | Bugfix for checking image flags | Oct 9 2017 | ||||
| 02646100e91f | Axel Kohlmeyer | correct handling of "at" keyword for netcdf dumps as suggested by @pastewka in… | Oct 9 2017 | ||||
| 7e58f084d226 | Michael Brown | Fixing bug in pppm/intel for AVX-512 with single precision and ik diff. This… | Oct 8 2017 | ||||
| 0f5d7dcc0f53 | Christoph Junghans | cmake: added USER-UEF | Oct 7 2017 | ||||
| b6187173e626 | Christoph Junghans | Merge branch 'master' into HEAD | Oct 7 2017 | ||||
| 88a33edb5022 | Steve Plimpton/GitHub | Merge pull request #680 from lammps/map-yes | Oct 7 2017 | ||||
| 6820db99e22f | Axel Kohlmeyer | avoid merge conflict | Oct 6 2017 | ||||
| 58e1969de241 | Axel Kohlmeyer | rename misleading "CPU time" into "Time spent" | Oct 6 2017 | ||||
| e91e505fb36e | Steve Plimpton | remove dependence of dump modify 'at' and 'append' | Oct 6 2017 | ||||
| f7cbdcf99584 | Steve Plimpton/GitHub | Merge pull request #673 from pastewka/17_dump_nc2 | Oct 6 2017 | ||||
| 4cfa88b70f90 | Steve Plimpton/GitHub | Merge pull request #674 from wmbrownIntel/user-intel-update | Oct 6 2017 | ||||
| 352a20fc1cb7 | Lars Pastewka | DOC: Updated doc to separate description of 'append' and 'at' keywords. | Oct 6 2017 | ||||
| dc0e20947ee7 | Lars Pastewka | MAINT: Return error when 'at' keyword is used without 'append yes'. | Oct 6 2017 | ||||
| 05847a0e8713 | Axel Kohlmeyer/GitHub | Merge branch 'master' into user-intel-update | Oct 6 2017 | ||||
| 439c2fd980f8 | Steve Plimpton/GitHub | Merge pull request #677 from stanmoore1/kk_update | Oct 6 2017 | ||||
| 15853a0e38dc | Steve Plimpton/GitHub | Merge pull request #676 from stanmoore1/kokkos_reverse_comm | Oct 6 2017 | ||||
| bd17ee5df74a | Steve Plimpton/GitHub | Merge pull request #675 from wesbarnett/master | Oct 6 2017 | ||||
| a9b7ff1154d3 | Steve Plimpton/GitHub | Merge pull request #679 from stanmoore1/kk_reax_comm | Oct 6 2017 | ||||
| 0dd7ba26c080 | Steve Plimpton/GitHub | Merge pull request #672 from akohlmey/phana-w-tricubic | Oct 6 2017 | ||||
| 7a90eef527ed | Steve Plimpton/GitHub | Merge pull request #668 from ovilab/modify_deallocation_fix | Oct 6 2017 | ||||
| 5d0626e50e30 | Steve Plimpton/GitHub | Merge pull request #665 from akohlmey/collected-small-fixes | Oct 6 2017 | ||||
| 4b7ca0383aac | Steve Plimpton/GitHub | Merge pull request #664 from timattox/kokkos_atom2bin | Oct 6 2017 | ||||
| 0ed987dc6186 | Steve Plimpton/GitHub | Merge pull request #663 from jdevemy/master | Oct 6 2017 | ||||
| 55a3fdca8065 | Steve Plimpton/GitHub | Merge pull request #660 from junghans/latte_fix | Oct 6 2017 | ||||
| 214c0cfb2b7e | Steve Plimpton | add atom_modify map yes, also timers to create_atoms and replicate | Oct 6 2017 | ||||
| e0efdd50fab3 | Stan Moore | Switch to classic comm if ghost_velocity. The check_forward and check_reverse… | Oct 5 2017 | ||||
| 44d2e8ff74d5 | Stan Moore | Add pre_reverse to verlet_kokkos and comment out timer | Oct 5 2017 | ||||
| 6bf2c60c07ed | Stan Moore | Fix issues in Kokkos comm | Oct 5 2017 | ||||
| eecd2fbaee77 | Stan Moore | Remove hardcoded value in fix_qeq_reax | Oct 5 2017 | ||||
| 2b0bfcb10f90 | Stan Moore | Fix memory leak in pair_reaxc_kokkos | Oct 5 2017 | ||||
| 3653f4012013 | Stan Moore | Reduce unnecessary communication in fix_qeq_reax | Oct 4 2017 | ||||
| bda0ee3aa1eb | Stan Moore | Destroy unneeded fix in pair_reaxc_kokkos | Oct 4 2017 | ||||
| 957263431aaf | Ulf R. Pedersen/GitHub | Ensure consistency with documentation | Oct 4 2017 | ||||
| c522b1b7a974 | Axel Kohlmeyer | add call to fftw_cleanup() before exiting to avoid bogus leak reports when… | Oct 4 2017 | ||||
| a55adf4a6848 | Stan Moore | Update to Kokkos r2.04.04 and add workaround for performance regression | Oct 3 2017 | ||||
| 2876baafd07d | James Barnett | Use -restrict whenever Intel is used, no matter the package | Oct 3 2017 | ||||
| ca032f21fbfa | Stan Moore | Add Kokkos threaded reverse comm option | Oct 3 2017 | ||||
| 197f08278442 | James Barnett | cmake: Add -restrict for Intel compilers for some packages | Oct 3 2017 | ||||
| 1bb7af9ef91a | Axel Kohlmeyer | integrate fix rhok into the LAMMPS source code management and documentation… | Oct 3 2017 | ||||
| 251f28049a3d | Axel Kohlmeyer | make fix rhok more similar to other LAMMPS sources | Oct 3 2017 | ||||
| f07719e924b2 | Axel Kohlmeyer | make fix rhok examples more consistent with LAMMPS conventions: | Oct 3 2017 | ||||
| 5f527091b8a6 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 30aaa7e47bb5 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 74dcf0bf9bfc | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| e9b07a7a1092 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| fd8f5f8f9e48 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 5c59eb637bca | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 250ef9f837be | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| e44f370d4949 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 1e790fbafef8 | Ulf R. Pedersen/GitHub | Update readme.md | Oct 3 2017 | ||||
| 35cc79597261 | Ulf R. Pedersen/GitHub | Update in.setup | Oct 3 2017 | ||||
| 245bf745521d | Ulf R. Pedersen/GitHub | Rename setup.lmp to in.setup | Oct 3 2017 | ||||
| 7e8bbe84814b | Ulf R. Pedersen/GitHub | Rename pinning.lmp to in.pinning | Oct 3 2017 | ||||
| e6d687faaca5 | Ulf R. Pedersen/GitHub | Rename crystal.lmp to in.crystal | Oct 3 2017 | ||||
| 8a2cf5ce8e77 | Ulf R. Pedersen/GitHub | reformatting and use citeme class | Oct 3 2017 | ||||
| 8f79f5ddb9da | Ulf R. Pedersen/GitHub | add the LAMMPS copyright | Oct 3 2017 |
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