MD-Bench/src
2022-07-10 21:13:37 +02:00
..
includes The program now does the binning on the GPU via the binatoms_cuda method 2022-07-10 18:05:06 +02:00
allocate.c Porting atom velocity memory layout to AoS, porting velocity integration to CUDA, adding measurements + logbook update 2022-01-01 18:18:12 +01:00
atom.c Porting atom velocity memory layout to AoS, porting velocity integration to CUDA, adding measurements + logbook update 2022-01-01 18:18:12 +01:00
eam_utils.c Add EAM without explicit types and update fp for PBC atoms 2021-11-03 00:57:24 +01:00
force_eam.c Add EAM without explicit types and update fp for PBC atoms 2021-11-03 00:57:24 +01:00
force-tracing.c Introduce separate version for traced force routine. 2021-10-26 09:11:17 +02:00
force.cu 🐛 Fixed aforementioned correctness issue by deleting a superflous cudaMemcpy in computeForce() that was overwriting correct data with incorrect data 2022-07-05 00:54:11 +02:00
main-stub.c Fix errors introduced by last changes 2021-10-26 01:19:11 +02:00
main.c 🐛 Fixed aforementioned correctness issue by deleting a superflous cudaMemcpy in computeForce() that was overwriting correct data with incorrect data 2022-07-05 00:54:11 +02:00
neighbor.cu Fixed compiler errors 2022-07-10 21:13:37 +02:00
pbc.cu Fixed compiler errors 2022-07-10 21:13:37 +02:00
stats.c Add first working version of EAM 2021-10-26 13:55:14 +02:00
thermo.c Porting atom velocity memory layout to AoS, porting velocity integration to CUDA, adding measurements + logbook update 2022-01-01 18:18:12 +01:00
timing.c Introduce generic variant targets 2021-04-12 08:24:27 +02:00
util.c Introduce generic variant targets 2021-04-12 08:24:27 +02:00
vtk.c Fix integration with mass and add VTK output 2021-10-29 16:52:19 +02:00