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lammps/src/REPLICA
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Axel Kohlmeyer ba1c848f43 Merge branch 'develop' into numerial_propagation
2023-11-16 12:01:11 -05:00
..
compute_event_displace.cpp
update developer reference text
2022-10-24 11:08:26 -04:00
compute_event_displace.h
update developer reference text
2022-10-24 11:08:26 -04:00
compute_pressure_alchemy.cpp
silence static code analysis warnings
2023-03-03 02:01:25 -05:00
compute_pressure_alchemy.h
add compute pressure/alchemy so it can be used with fix npt
2023-02-25 10:43:49 -05:00
compute_pressure_grem.cpp
update developer reference text
2022-10-24 11:08:26 -04:00
compute_pressure_grem.h
update developer reference text
2022-10-24 11:08:26 -04:00
fix_alchemy.cpp
use references instead of copies when looping over list of selected fixes
2023-08-03 11:00:05 -04:00
fix_alchemy.h
incorporate changes to fix alchemy from @sjplimp
2023-03-06 12:14:57 -05:00
fix_event_hyper.cpp
update developer reference text
2022-10-24 11:08:26 -04:00
fix_event_hyper.h
update developer reference text
2022-10-24 11:08:26 -04:00
fix_event_prd.cpp
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2022-10-24 11:08:26 -04:00
fix_event_prd.h
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2022-10-24 11:08:26 -04:00
fix_event_tad.cpp
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2022-10-24 11:08:26 -04:00
fix_event_tad.h
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2022-10-24 11:08:26 -04:00
fix_event.cpp
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2022-10-24 11:08:26 -04:00
fix_event.h
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2022-10-24 11:08:26 -04:00
fix_grem.cpp
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2022-10-24 11:08:26 -04:00
fix_grem.h
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2022-10-24 11:08:26 -04:00
fix_hyper_global.cpp
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2022-10-24 11:08:26 -04:00
fix_hyper_global.h
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2022-10-24 11:08:26 -04:00
fix_hyper_local.cpp
getting out of the insurance business :-)
2023-01-23 16:45:41 -05:00
fix_hyper_local.h
update developer reference text
2022-10-24 11:08:26 -04:00
fix_hyper.cpp
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2022-10-24 11:08:26 -04:00
fix_hyper.h
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2022-10-24 11:08:26 -04:00
fix_neb.cpp
simplified logic from clang-tidy
2023-03-26 21:33:37 -04:00
fix_neb.h
move enum to .cpp file and away from header
2023-01-12 18:50:34 -05:00
fix_pimd_langevin.cpp
Merge branch 'develop' into numerial_propagation
2023-11-16 12:01:11 -05:00
fix_pimd_langevin.h
add support for method=PIMD; add q_step function
2023-11-10 00:20:51 -05:00
fix_pimd_nvt.cpp
support sp in fix pimd/nvt
2023-03-18 10:25:05 -04:00
fix_pimd_nvt.h
make non-polymorph functions and all data members protected.
2023-02-27 12:12:39 -05:00
hyper.cpp
next round of IWYU updates
2022-12-12 01:07:46 -05:00
hyper.h
update developer reference text
2022-10-24 11:08:26 -04:00
neb.cpp
remove redundant calls to fmt::format() from calls to error->one/all() and utils::logmesg()
2023-09-26 23:56:51 -04:00
neb.h
move enum to .cpp file and away from header
2023-01-12 18:50:34 -05:00
prd.cpp
getting out of the insurance business :-)
2023-01-23 16:45:41 -05:00
prd.h
update developer reference text
2022-10-24 11:08:26 -04:00
tad.cpp
rename fix STORE/PERATOM to STORE/ATOM
2023-03-13 22:33:47 -04:00
tad.h
rename fix STORE/PERATOM to STORE/ATOM
2023-03-13 22:33:47 -04:00
temper_grem.cpp
remove redundant calls to fmt::format() from calls to error->one/all() and utils::logmesg()
2023-09-26 23:56:51 -04:00
temper_grem.h
update comment
2023-07-17 09:52:44 -04:00
temper_npt.cpp
modernize and consolidate style across all three temper command variants
2023-07-15 12:37:12 -04:00
temper_npt.h
update comment
2023-07-17 09:52:44 -04:00
temper.cpp
modernize and consolidate style across all three temper command variants
2023-07-15 12:37:12 -04:00
temper.h
update comment
2023-07-17 09:52:44 -04:00
verlet_split.cpp
getting out of the insurance business :-)
2023-01-23 16:45:41 -05:00
verlet_split.h
update developer reference text
2022-10-24 11:08:26 -04:00