- Jan 31, 2019
-
-
Axel Kohlmeyer authored
Collected small changes and bugfixes for the next patch release
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
must convert regions bounding box to lattice coordinates before checking to reduce lattice creation range
-
Axel Kohlmeyer authored
Replace bundled moltemplate distribution with installation instructions only
-
Axel Kohlmeyer authored
Combined USER-FEP related updates
-
Axel Kohlmeyer authored
Support using fix qeq/shielded with pair style reax/c
-
Axel Kohlmeyer authored
Added 4D memory grow routine
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
Optimize performance of create_atoms for large boxes and small regions
-
Axel Kohlmeyer authored
compute entropy/atom - enhancement/optimization
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
- Jan 30, 2019
-
-
Axel Kohlmeyer authored
-
PabloPiaggi authored
-
PabloPiaggi authored
-
Axel Kohlmeyer authored
Fix in extract() method of pair_thole
-
- Jan 29, 2019
-
-
Agilio Padua authored
-
- Jan 26, 2019
-
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
- Jan 25, 2019
-
-
https://github.com/agiliopadua/lammpsAxel Kohlmeyer authored
Merge branch 'core_soft' of https://github.com/agiliopadua/lammps into combined-user-fep-soft-updates Resolved Conflicts: doc/src/Commands_pair.txt doc/src/pair_fep_soft.txt doc/src/pair_style.txt doc/src/pairs.txt
-
Agilio Padua authored
-
Axel Kohlmeyer authored
ENH: Output computes/fixes of with arbitrary number of columns to NetCDF
-
- Jan 24, 2019
-
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Agilio Padua authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
Axel Kohlmeyer authored
-
https://github.com/agiliopadua/lammpsAxel Kohlmeyer authored
Merge branch 'core_soft' of https://github.com/agiliopadua/lammps into combined-user-fep-soft-updates Resolved Conflicts: doc/src/compute_fep.txt doc/src/fix_adapt_fep.txt
-
-
https://github.com/evoyiatzis/lammpsAxel Kohlmeyer authored
Merge branch 'soft_class2_potentials' of https://github.com/evoyiatzis/lammps into combined-user-fep-soft-updates
-
Axel Kohlmeyer authored
-