sPuReMD: add preconditioner choice parameter and refactor code. Update simulation runner script.
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- sPuReMD/src/GMRES.c 372 additions, 455 deletionssPuReMD/src/GMRES.c
- sPuReMD/src/GMRES.h 6 additions, 13 deletionssPuReMD/src/GMRES.h
- sPuReMD/src/QEq.c 37 additions, 45 deletionssPuReMD/src/QEq.c
- sPuReMD/src/control.c 7 additions, 1 deletionsPuReMD/src/control.c
- sPuReMD/src/mytypes.h 8 additions, 3 deletionssPuReMD/src/mytypes.h
- tools/run_sim.py 100 additions, 44 deletionstools/run_sim.py
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