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root/group/trunk/nano_mpi/Linux/force_goddard_module.d
Revision: 4
Committed: Mon Jun 10 17:18:36 2002 UTC (22 years, 1 month ago) by chuckv
File size: 9376 byte(s)
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File Contents

# Content
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36 PnPnGODDARD_MODULERHO_RCUTREALRCUTGEVALS SECOND_DERIVD PRINT_VAC PARAMETERLOGICALUSE_TARGET_TEMPUSE_LANGEVIN_SKINLANGEVIN_SKIN_DELTA BATH_TEMPETA NEWTONS_THRDNCELLSINTEGERDENSITYSOLUTE_X SOLVENT_MODEL CHARACTER SOLUTE_MODELVACANCY_FRACTIONVACANCY_RADIUSCELLR_SHELLR_CORE SHELL_MODEL
37 CORE_MODEL CHECKTEMPWRITE_CONFIG_STEPSCHECK_TEMP_STEPSISEED TARGET_TEMPRUN_TIMETHERM_VARIANCESKIN_THICKNESSRCUTDT EAM_POT_DIR FORCE_FIELDENSEMBLESIM_TYPECOMMAND FILE_PREFIX PARAMFILE COMM_TIME
38 SIMULATION
39 FORCE_TIMEUSE_PBCBOXMODELLISTPOINTRCUTSQRLSTSQQ0MASSFRHORHOEFVQ
40 MASS_LOCAL
41 TOTAL_MASSTEMPN_ATYPES_PRESENTPRESENT_ATYPESIDENT
42 ATOM_INDEXNA
43 NMOL_LOCALNLOCALNATOMSNMOLDP DEFINITIONS
44 ERROR_UNITIO_UNITS OUTPUT_UNITNDIMIFLPORT
45 FILE_UNITSSTATUSFORCE_UTILITIES MASS_WEIGHTINITIALIZE_GODDARDCALC_GODDARD_FORCESNMFLAGPOTCALC_GODDARD_DENS UPDATE_NLISTDEALLOCATE_GODDARD_MODULEALLOCATE_GODDARD_MODULE N_SIZE_ATYPEWRAP THIS_WRAPRDIM
46 SAVE_NLISTCHECK DEALLOC_EVALS ALLOC_EVALSDEALLOC_SEC_DERIVALLOC_SEC_DERIVINFOROUTINEMESSAGEWARNINGERROR ERROR_MSGCODE READ_PARAMS
47 THIS_ERROR HANDLE_ARGSDEALLOCATE_SIMULATIONALLOCATE_SIMULATIONN_SIZEN_COLALLOCATE_ERRORALLOCATE_NMOL_ARRAYS