History Graph
History Graph
Commit | Author | Details | Committed | |||
---|---|---|---|---|---|---|
6873ab71863b | Pierre de Buyl | fix dump_charge data name | Aug 3 2015 | |||
c94f63cb808f | Pierre de Buyl | Update of lib/ch5md and corresponding changes to USER-H5MD | Apr 8 2015 | |||
485b411d0f27 | Pierre de Buyl/Pierre de Buyl | Allow optional author name in dump_h5md | Dec 5 2014 | |||
1252fb3e6262 | Pierre de Buyl/Pierre de Buyl | close HDF5 data only on root node | Dec 5 2014 | |||
1fa74d14d508 | Pierre de Buyl/Pierre de Buyl | Generate error with triclinic domains | Dec 5 2014 | |||
5e63424f304d | Pierre de Buyl/Pierre de Buyl | Update ch5md and close properly HDF5 identifiers (except file). | Dec 5 2014 | |||
e8de865a3081 | Pierre de Buyl/Pierre de Buyl | Change the parsing of 'every' for dump_h5md | Dec 5 2014 | |||
1fddfe78539c | Pierre de Buyl/Pierre de Buyl | Modify dump_h5md to allow use with write_dump | Dec 5 2014 | |||
f2900c0a52e0 | Pierre de Buyl/Pierre de Buyl | Allow write_dump to add fixed-in-time elements | Dec 5 2014 | |||
679d74c908bd | Pierre de Buyl/Pierre de Buyl | Use LAMMPS_VERSION in dump_h5md | Dec 5 2014 | |||
8ee4b05d2be7 | Pierre de Buyl/Pierre de Buyl | Include box data in the situation where there is no position. | Dec 5 2014 | |||
cc4adb535a65 | Pierre de Buyl/Pierre de Buyl | Fix k_species count (dimension is always '1' and not 'dim'). | Dec 5 2014 | |||
5509eeef9524 | Pierre de Buyl/Pierre de Buyl | Force packing and unpacking of all existing elements at each dump. Else, the… | Dec 5 2014 | |||
2443bce1c440 | Pierre de Buyl/Pierre de Buyl | Add pack and write for velocity, force and species | Dec 5 2014 | |||
e3d12cbafeed | Pierre de Buyl/Pierre de Buyl | Refactor pack loop | Dec 5 2014 | |||
9717e0983367 | Pierre de Buyl/Pierre de Buyl | Add variables, argument parsing and h5md elements creation for velocity, force… | Dec 5 2014 | |||
b516393fc6d4 | Pierre de Buyl/Pierre de Buyl | Remove 'every' check for image, include in position check | Dec 5 2014 | |||
ae115b3fd349 | Pierre de Buyl/Pierre de Buyl | Make image always match position | Dec 5 2014 | |||
692b14eb741b | Pierre de Buyl/Pierre de Buyl | Modularize writing of position and image in dump_h5md. | Dec 5 2014 | |||
4d6ef607b7d3 | Pierre de Buyl/Pierre de Buyl | Change name of coords array to dump_position. | Dec 5 2014 | |||
d124cf1baeb3 | Pierre de Buyl/Pierre de Buyl | Add image element. | Dec 5 2014 | |||
dee5c2f8e684 | Pierre de Buyl/Pierre de Buyl | Fix library flags. | Dec 5 2014 | |||
86a050c200f9 | Pierre de Buyl/Pierre de Buyl | Add contributing author notice. | Dec 5 2014 | |||
dc8d5a8ba38e | Pierre de Buyl/Pierre de Buyl | Add a README for USER-H5MD | Dec 5 2014 | |||
39494d07ee60 | Pierre de Buyl/Pierre de Buyl | Fix dimension count in write_data. | Dec 5 2014 | |||
97ca47a42478 | Pierre de Buyl/Pierre de Buyl | Also remove -lhdf5 when no-ing USER-H5MD. | Dec 5 2014 | |||
329f22670722 | Pierre de Buyl/Pierre de Buyl | Take into account domain boundary. | Dec 5 2014 | |||
095e00995be6 | Pierre de Buyl/Pierre de Buyl | move ch5md to lib | Dec 5 2014 | |||
932bbb05f91a | Pierre de Buyl/Pierre de Buyl | fix value of time in h5md_append | Dec 5 2014 | |||
8863ba6933d8 | Pierre de Buyl/Pierre de Buyl | Fix handling of domain dimension. | Dec 5 2014 | |||
ebfb09b17d16 | Pierre de Buyl/Pierre de Buyl | correct dims inversion of natoms and dimension | Dec 5 2014 | |||
1e82a1905d8c | Pierre de Buyl/Pierre de Buyl | correct free into delete | Dec 5 2014 | |||
0b262350e073 | Pierre de Buyl/Pierre de Buyl | Add initial version of dump_h5md | Dec 5 2014 |
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