History Graph
History Graph
| Commit | Author | Details | Committed | |||
|---|---|---|---|---|---|---|
| d66493ca13c8 | Axel Kohlmeyer | whitespace cleanup | Sep 16 2016 | |||
| bb234349ec86 | Axel Kohlmeyer | Merge branch 'initialize_pointers' of https://github.com/andeplane/lammps into… | Aug 29 2016 | |||
| 1825f12c2931 | Axel Kohlmeyer | address issues detected by coverity scan | Aug 26 2016 | |||
| 90d22706cccd | Anders Hafreager | Fixed initialization of arrays in computes/fixes in MC package | Aug 25 2016 | |||
| be732e60989f | Axel Kohlmeyer | simplify fix bond/create code a little more | Aug 24 2016 | |||
| c3ddb9eae91c | aaramoon | merged, small bugs fixed | Aug 24 2016 | |||
| ceb4ba09196e | aaramoon | Merge branch 'merge-pull-140' of https://github.com/akohlmey/lammps into… | Aug 24 2016 | |||
| 958293f640a4 | aaramoon | memory leak fixed | Aug 24 2016 | |||
| 93b8d00a5946 | Axel Kohlmeyer | significant refactoring of argument parsing and checking in fix bond/create | Aug 24 2016 | |||
| 8465b417f6b9 | Axel Kohlmeyer | remove xxxdynflag. we will check on pointers being valid instead. | Aug 24 2016 | |||
| f4a89d56fcf9 | Axel Kohlmeyer | refactoring of TypeDetector class | Aug 24 2016 | |||
| bddb31ea43d0 | Axel Kohlmeyer | various small cleanup steps to dynamic type selection for… | Aug 23 2016 | |||
| 49597fa96025 | aaramoon | memory leak resolved | Aug 23 2016 | |||
| a2e882daa290 | aaramoon | enum added in type detector | Aug 23 2016 | |||
| d1ba974fa8ee | aaramoon | correction made | Aug 23 2016 | |||
| 180776e4f702 | aaramoon | fix_bond_create_updated | Aug 17 2016 | |||
| 4320104f4990 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Jul 1 2016 | |||
| f735a669ad01 | athomps | Fixed bug in qtype bugfix | Jun 30 2016 | |||
| 0f3e4182e869 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15109 f3b2605a-c512-4ea7… | Jun 7 2016 | |||
| d89388fd5ea4 | Axel Kohlmeyer | make files safe against division by zero when computing center of mass for a… | Jun 4 2016 | |||
| 876b033ea862 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15083 f3b2605a-c512-4ea7… | May 31 2016 | |||
| 71c36003b934 | athomps | Added Axel's improvement | May 26 2016 | |||
| edb8cfcb6a85 | Axel Kohlmeyer | improve check for fix rigid in fix gcmc to flag incompatibility | May 25 2016 | |||
| eecee57de649 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | May 25 2016 | |||
| 97b8a30b72c8 | athomps | Blocked fix rigid | May 25 2016 | |||
| 068898765ab5 | Axel Kohlmeyer | second round of making per-atom allocations consistent. | May 13 2016 | |||
| 4c07a99a7a88 | Axel Kohlmeyer | make certain, that per atom storage is consistently allocated for per-atom… | May 13 2016 | |||
| 212f64d2f16f | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@15040 f3b2605a-c512-4ea7… | May 12 2016 | |||
| d0696ed79cb6 | Axel Kohlmeyer | fix minor issues flagged by gcc 6.1 | Apr 28 2016 | |||
| e18f5a903bba | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14835 f3b2605a-c512-4ea7… | Apr 15 2016 | |||
| eb8fdc4ab680 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14831 f3b2605a-c512-4ea7… | Apr 15 2016 | |||
| f81130561eb4 | Axel Kohlmeyer | make certain that "nevery" flags have sane values | Apr 15 2016 | |||
| aaea1726ebd5 | Axel Kohlmeyer | avoid segfault due to using a class after it was deleted | Apr 11 2016 | |||
| 5ee04e33b1d5 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Mar 1 2016 | |||
| b2e792d6ac80 | athomps | fixed problem with exclusion | Feb 29 2016 | |||
| 2702d94cfd5e | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Feb 26 2016 | |||
| 737c083a4f3f | athomps | Enabled triclinic cells | Feb 26 2016 | |||
| 1d9d6f924170 | Axel Kohlmeyer | Merge remote branch 'lammps-ro/master' into lammps-icms | Feb 16 2016 | |||
| 70aa37e4c852 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14589 f3b2605a-c512-4ea7… | Feb 15 2016 | |||
| 6ed1f1df2f87 | Axel Kohlmeyer | Merge remote branch 'lammps-ro/master' into lammps-icms | Feb 9 2016 | |||
| 9e20448834a5 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14582 f3b2605a-c512-4ea7… | Feb 8 2016 | |||
| 9195c252ee00 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Dec 12 2015 | |||
| 921bcfb12d17 | athomps | Allowed non-full_energy with triclinic | Dec 12 2015 | |||
| da1a3ac83af4 | athomps | Fixed error in onemols initialization when gcmc uses non-first molecule template | Nov 12 2015 | |||
| b3aec4ebd8f1 | Axel Kohlmeyer | remove molecule template index bug in fix gcmc | Nov 11 2015 | |||
| 1e9a4cc4b808 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Oct 31 2015 | |||
| 354e20f43157 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14220 f3b2605a-c512-4ea7… | Oct 30 2015 | |||
| 3bbba19e854a | Axel Kohlmeyer | correct bug in cleanup script and update permissions accordingly | Oct 27 2015 | |||
| 9c8fb961dcba | Axel Kohlmeyer | fix permissions for source files | Oct 24 2015 | |||
| 823cc16bdf78 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Oct 22 2015 | |||
| 4ce32a301c7d | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14156 f3b2605a-c512-4ea7… | Oct 21 2015 | |||
| bc1cf9965e75 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14155 f3b2605a-c512-4ea7… | Oct 21 2015 | |||
| 9a878cdd6718 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14128 f3b2605a-c512-4ea7… | Oct 21 2015 | |||
| 8a0500fb1caa | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Oct 20 2015 | |||
| 7b16c435b6c2 | athomps | Made molecule ID for molecule group to minus 1 | Oct 19 2015 | |||
| 864a51e82f89 | Axel Kohlmeyer | remove API name clash | Oct 16 2015 | |||
| 47c291386261 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Oct 16 2015 | |||
| ce6210557023 | athomps | Require type argument be zero when mol keyword used | Oct 15 2015 | |||
| f4ecd05c8f98 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Oct 14 2015 | |||
| 537e951c6d8d | athomps | added tfac_insert keyword and changed molecule insertion velocities PRNG | Oct 13 2015 | |||
| 568a47c83968 | Axel Kohlmeyer | remove pointless checks for bigint overflows. | Sep 29 2015 | |||
| 448b9f66f0fa | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14058 f3b2605a-c512-4ea7… | Sep 24 2015 | |||
| 1d21e2c08a0c | Axel Kohlmeyer | remove unused variable | Sep 21 2015 | |||
| e032cd7be69a | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Sep 13 2015 | |||
| ed7559f32957 | athomps | Made insertion work correctly for triclinic | Sep 12 2015 | |||
| 5603ea6d27ee | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Sep 12 2015 | |||
| 5cbf3cfba5f1 | athomps | Fixed triclinic bug in gcmc and qtype bug atom/swap | Sep 12 2015 | |||
| 54210d7a9b2f | athomps | Fixed triclinic bug in gcmc and qtype bug atom/swap | Sep 11 2015 | |||
| 68c691f4015e | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Aug 11 2015 | |||
| 4b03a29c04e5 | athomps | Fixed molecule mass when gcmc offset applied | Aug 10 2015 | |||
| 0d075b7986f3 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Aug 2 2015 | |||
| 354ee97d351e | athomps | Added fix gcmc check to init() | Aug 2 2015 | |||
| e8a42c4efb69 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Jul 8 2015 | |||
| e52b320061bd | athomps | Enabled Coulombic pair styles without energy_full | Jul 8 2015 | |||
| c368b5f9889d | athomps | Added protection against using charges without full_energy | Jul 8 2015 | |||
| 8749c91a3ce8 | athomps | Changed algorithm for generating rotation axis | Jul 7 2015 | |||
| f03b5a8036fa | athomps | Fixed problem with image flags in attempt_molecule_insertion_full() and cleaned… | Jul 7 2015 | |||
| 69b8a38a9c80 | Axel Kohlmeyer | Merge remote branch 'lammps-ro/master' into lammps-icms | May 19 2015 | |||
| d9be5d7d63d3 | athomps | Switched some inside() checks to inside_nonperiodic() checks | May 18 2015 | |||
| bff094784db4 | athomps | Added error message to list | May 18 2015 | |||
| f9de6b9e61a9 | Axel Kohlmeyer | Merge remote branch 'lammps-ro/master' into lammps-icms | May 16 2015 | |||
| 26c09979f3b0 | athomps | Added inside box check for fix_gcmc moves | May 16 2015 | |||
| aef75ace77e7 | athomps | Added inside box check for fix_gcmc moves | May 16 2015 | |||
| 5f17c678555e | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | May 12 2015 | |||
| d2f90c7e0c6d | athomps | Added intra_energy keyword | May 12 2015 | |||
| 720490cfa461 | athomps | Added group keywords to fix gcmc, fixed destructor | May 12 2015 | |||
| a6f703593c9b | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | May 9 2015 | |||
| 0c0441b870a0 | athomps | Added group keywords to fix gcmc | May 8 2015 | |||
| 5779fc409753 | athomps | Added group keywords to fix gcmc | May 8 2015 | |||
| 73a87e7923d4 | athomps | Added group keywords to fix gcmc | May 8 2015 | |||
| fd32e81a7b00 | Axel Kohlmeyer | fix permissions for source files | Mar 27 2015 | |||
| 99d694e5d5b4 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Mar 26 2015 | |||
| 1f6a1f4ad4f1 | pscrozi | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13298 f3b2605a-c512-4ea7… | Mar 25 2015 | |||
| f07750fa88ae | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13291 f3b2605a-c512-4ea7… | Mar 25 2015 | |||
| 5f0a75251391 | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Mar 25 2015 | |||
| 1d7421d4122c | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13284 f3b2605a-c512-4ea7… | Mar 24 2015 | |||
| 895cb00e98cf | Axel Kohlmeyer | Merge remote-tracking branch 'lammps-ro/master' into lammps-icms | Mar 24 2015 | |||
| ac0b1d1ac371 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13280 f3b2605a-c512-4ea7… | Mar 24 2015 | |||
| 94d653c282ce | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13277 f3b2605a-c512-4ea7… | Mar 24 2015 | |||
| a71d94841a89 | pscrozi | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@13276 f3b2605a-c512-4ea7… | Mar 23 2015 |
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