Edited all main files except imd_forces_nbl.c indorder to implement KERMODE potentials in IMD
KERMODE potential is implemented and tested all energies and forces which seems working fine
Implemented KERMODE potentials in IMD and checked it with 8400 atoms nve simulation with 100 steps and Everything is working now
Working code: After little changes
Corrected PRESSTENS calculation in imd_forces_meam.c for proper pressure relaxation using homdef.
Corrected PRESSTENS calculation in imd_forces_meam.c
Merge remote-tracking branch 'upstream/master'

Merging the CBegau into the code where Kermode potential was implemented
Merge remote-tracking branch 'upstream/master'

Merged the jomoeller changes with the code where kermode was implemented and also  merged the CBegau changes.
Merged the changes from CBegau and jomoeller
Fixed a small bug in imd_param.c for kermode potential (line 4850 changed precompilation tag from DIPOLE to KERMODE)
Implemented the parallelization part of BECK(dipole option) and KERMODE potentials and tested: everything is working well
dp_sum in the convergence is updated to dp_sum_global
Sorry... still there is a bug in the parallelisation of KERMODE and DIPOLE part of the imd code. Details of the bug: when atom moves from one cpu to another cpu, instead of resetting DP_E_IND value to zero, it is getting accumulated which results an error in the dipole convergence because of the dp_sum_global is getting more than 500. Status Now: the bug is solved and tested for differenct configurations (52488 atoms - using 2 to 216 processors)- it seems everything is working fine now
Merge branch 'master' of https://github.com/biterik/imd
Merged the changes from Prof. Bitzek Erik (Compilation flags for emmy)
Merge pull request #3 from sudheerganisetti/master

KERMODE (screened TS) potentials for Silica