Axel Kohlmeyer 7249aea5e5 error out when no per-type masses are set. warn if both per-type and per-atom masses are used.

2023-11-27 07:47:08 -05:00

..

fix_atom_swap.cpp

error out when no per-type masses are set. warn if both per-type and per-atom masses are used.

2023-11-27 07:47:08 -05:00

fix_atom_swap.h

add mc_active to header

2023-02-13 11:38:24 -07:00

fix_bond_break.cpp

getting out of the insurance business :-)

2023-01-23 16:45:41 -05:00

fix_bond_break.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_bond_create_angle.cpp

update developer reference text

2022-10-24 11:08:26 -04:00

fix_bond_create_angle.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_bond_create.cpp

getting out of the insurance business :-)

2023-01-23 16:45:41 -05:00

fix_bond_create.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_bond_swap.cpp

getting out of the insurance business :-)

2023-01-23 16:45:41 -05:00

fix_bond_swap.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_charge_regulation.cpp

handle exceptions in destructors

2023-04-08 16:36:52 -04:00

fix_charge_regulation.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_gcmc.cpp

Merge branch 'develop' into collected_small_changes

2023-06-14 18:24:18 -04:00

fix_gcmc.h

whitespace fixes

2023-02-21 16:31:45 -05:00

fix_mol_swap.cpp

getting out of the insurance business :-)

2023-01-23 16:45:41 -05:00

fix_mol_swap.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_sgcmc.cpp

apply changes suggested by clang-tidy

2023-01-27 11:49:43 -05:00

fix_sgcmc.h

remove dead code

2022-12-15 22:56:58 -05:00

fix_tfmc.cpp

update developer reference text

2022-10-24 11:08:26 -04:00

fix_tfmc.h

update developer reference text

2022-10-24 11:08:26 -04:00

fix_widom.cpp

Adding redundant call to sync Intel package arrays with native arrays for methods such as MC that do not need pre_reverse.

2023-06-06 23:56:16 -07:00

fix_widom.h

update developer reference text

2022-10-24 11:08:26 -04:00

Install.sh

build system support: fix sgcmc may only be compiled if EAM is available

2022-12-13 16:35:19 -05:00

pair_dsmc.cpp

update developer reference text

2022-10-24 11:08:26 -04:00

pair_dsmc.h

update developer reference text

2022-10-24 11:08:26 -04:00