------- Comment #24 from jv244 at cam dot ac dot uk 2009-01-09 06:18 ------- (In reply to comment #22) > Program received signal SIGSEGV, Segmentation fault. > __mc_moves_MOD_change_bond_length () at > /scratch/vondele/clean/cp2k/src/../src/mc_moves.F:1434 > 1434 atom_b(:)=0 >
additional valgrind info: ==4525== Use of uninitialised value of size 8 ==4525== at 0xB93AFB: __mc_moves_MOD_change_bond_length (mc_moves.F:1434) ==4525== by 0xB9C478: __mc_moves_MOD_mc_conformation_change (mc_moves.F:273) ==4525== by 0xB68830: __mc_ensembles_MOD_mc_run_ensemble (mc_ensembles.F:754) ==4525== by 0xBA4623: __mc_run_MOD_do_mon_car (mc_run.F:328) ==4525== by 0x562C3F: __cp2k_runs_MOD_cp2k_run (cp2k_runs.F:335) ==4525== by 0x565B36: __cp2k_runs_MOD_run_input (cp2k_runs.F:1079) ==4525== by 0x1456510: MAIN__ (cp2k.F:272) ==4525== by 0x14575E9: main (fmain.c:21) ==4525== ==4525== Invalid write of size 4 ==4525== at 0xB93AFB: __mc_moves_MOD_change_bond_length (mc_moves.F:1434) ==4525== by 0xB9C478: __mc_moves_MOD_mc_conformation_change (mc_moves.F:273) ==4525== by 0xB68830: __mc_ensembles_MOD_mc_run_ensemble (mc_ensembles.F:754) ==4525== by 0xBA4623: __mc_run_MOD_do_mon_car (mc_run.F:328) ==4525== by 0x562C3F: __cp2k_runs_MOD_cp2k_run (cp2k_runs.F:335) ==4525== by 0x565B36: __cp2k_runs_MOD_run_input (cp2k_runs.F:1079) ==4525== by 0x1456510: MAIN__ (cp2k.F:272) ==4525== by 0x14575E9: main (fmain.c:21) ==4525== Address 0x4 is not stack'd, malloc'd or (recently) free'd ==4525== ==4525== Process terminating with default action of signal 11 (SIGSEGV) ==4525== Access not within mapped region at address 0x4 ==4525== at 0xB93AFB: __mc_moves_MOD_change_bond_length (mc_moves.F:1434) ==4525== by 0xB9C478: __mc_moves_MOD_mc_conformation_change (mc_moves.F:273) ==4525== by 0xB68830: __mc_ensembles_MOD_mc_run_ensemble (mc_ensembles.F:754) ==4525== by 0xBA4623: __mc_run_MOD_do_mon_car (mc_run.F:328) ==4525== by 0x562C3F: __cp2k_runs_MOD_cp2k_run (cp2k_runs.F:335) ==4525== by 0x565B36: __cp2k_runs_MOD_run_input (cp2k_runs.F:1079) ==4525== by 0x1456510: MAIN__ (cp2k.F:272) ==4525== by 0x14575E9: main (fmain.c:21) -- http://gcc.gnu.org/bugzilla/show_bug.cgi?id=38431