----- GAMESS execution script 'rungms' ----- This job is running on host Mac-Pro.local under operating system Darwin at Fri Mar 30 16:20:52 CDT 2012 Available scratch disk space (Kbyte units) at beginning of the job is Filesystem 1024-blocks Used Available Capacity Mounted on /dev/disk2 145372476 142717036 2399440 99% / Copying input file data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.inp to your run's scratch directory... cp data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.inp .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F05 unset echo setenv AUXDATA .//auxdata setenv EXTBAS /dev/null setenv NUCBAS /dev/null setenv POSBAS /dev/null setenv ERICFMT .//auxdata/ericfmt.dat setenv MCPPATH .//auxdata/MCP setenv BASPATH .//auxdata/BASES setenv QUANPOL .//auxdata/QUANPOL setenv MAKEFP .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.efp setenv GAMMA .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.gamma setenv TRAJECT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.trj setenv RESTART .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.rst setenv INPUT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F05 setenv PUNCH .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.dat setenv AOINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F08 setenv MOINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F09 setenv DICTNRY .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F10 setenv DRTFILE .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F11 setenv CIVECTR .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F12 setenv CASINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F13 setenv CIINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F14 setenv WORK15 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F15 setenv WORK16 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F16 setenv CSFSAVE .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F17 setenv FOCKDER .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F18 setenv WORK19 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F19 setenv DASORT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F20 setenv DFTINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F21 setenv DFTGRID .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F22 setenv JKFILE .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F23 setenv ORDINT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F24 setenv EFPIND .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F25 setenv PCMDATA .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F26 setenv PCMINTS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F27 setenv SVPWRK1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F26 setenv SVPWRK2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F27 setenv COSCAV .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F26 setenv COSDATA ~jayson/scr/data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.cosmo setenv COSPOT ~jayson/scr/data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.pot setenv MLTPL .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F28 setenv MLTPLT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F29 setenv DAFL30 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F30 setenv SOINTX .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F31 setenv SOINTY .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F32 setenv SOINTZ .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F33 setenv SORESC .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F34 setenv GCILIST .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F37 setenv HESSIAN .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F38 setenv QMMMTEI .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F39 setenv SOCCDAT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F40 setenv AABB41 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F41 setenv BBAA42 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F42 setenv BBBB43 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F43 setenv MCQD50 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F50 setenv MCQD51 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F51 setenv MCQD52 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F52 setenv MCQD53 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F53 setenv MCQD54 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F54 setenv MCQD55 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F55 setenv MCQD56 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F56 setenv MCQD57 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F57 setenv MCQD58 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F58 setenv MCQD59 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F59 setenv MCQD60 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F60 setenv MCQD61 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F61 setenv MCQD62 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F62 setenv MCQD63 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F63 setenv MCQD64 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F64 setenv NMRINT1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F61 setenv NMRINT2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F62 setenv NMRINT3 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F63 setenv NMRINT4 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F64 setenv NMRINT5 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F65 setenv NMRINT6 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F66 setenv DCPHFH2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F67 setenv DCPHF21 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F68 setenv ELNUINT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F67 setenv NUNUINT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F68 setenv GVVPT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F69 setenv NUMOIN .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F69 setenv NUMOCAS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F70 setenv NUELMO .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F71 setenv NUELCAS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F72 setenv RIVMAT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F51 setenv RIT2A .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F52 setenv RIT3A .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F53 setenv RIT2B .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F54 setenv RIT3B .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F55 setenv GMCREF .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F70 setenv GMCO2R .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F71 setenv GMCROC .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F72 setenv GMCOOC .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F73 setenv GMCCC0 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F74 setenv GMCHMA .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F75 setenv GMCEI1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F76 setenv GMCEI2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F77 setenv GMCEOB .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F78 setenv GMCEDT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F79 setenv GMCERF .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F80 setenv GMCHCR .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F81 setenv GMCGJK .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F82 setenv GMCGAI .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F83 setenv GMCGEO .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F84 setenv GMCTE1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F85 setenv GMCTE2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F86 setenv GMCHEF .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F87 setenv GMCMOL .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F88 setenv GMCMOS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F89 setenv GMCWGT .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F90 setenv GMCRM2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F91 setenv GMCRM1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F92 setenv GMCR00 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F93 setenv GMCRP1 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F94 setenv GMCRP2 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F95 setenv GMCVEF .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F96 setenv GMCDIN .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F97 setenv GMC2SZ .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F98 setenv GMCCCS .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F99 unset echo .//ddikick.x .//gamess.Aug112011R1.x data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G -ddi 8 8 localhost localhost localhost localhost localhost localhost localhost localhost -scr ./ Distributed Data Interface kickoff program. Initiating 8 compute processes on 8 nodes to run the following command: .//gamess.Aug112011R1.x data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G DDI Process 15: error code 911 DDI Process 15: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 14: error code 911 DDI Process 14: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 2: error code 911 DDI Process 2: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 7: error code 911 DDI Process 10: error code 911 DDI Process 7: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 10: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 1: error code 911 DDI Process 1: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 3: error code 911 DDI Process 3: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 5: error code 911 DDI Process 5: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 0: error code 911 DDI Process 0: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 DDI Process 8: error code 911 DDI Process 8: TCP Error in Recv. TCP recv error: Unknown. TCP recv error: return value errno=0 ddikick.x: Timed out while waiting for DDI processes to check in. ddikick.x: Fatal error detected. The error is most likely to be in the application, so check for input errors, disk space, memory needs, application bugs, etc. ddikick.x will now clean up all processes, and exit... DDI Process 4: terminated upon request. DDI Process 6: terminated upon request. DDI Process 9: terminated upon request. DDI Process 11: terminated upon request. DDI Process 12: terminated upon request. DDI Process 13: terminated upon request. ddikick.x: Sending kill signal to DDI processes. ddikick.x: Execution terminated due to error(s). unset echo ----- accounting info ----- Files used on the master node Mac-Pro.local were: -rw-r--r-- 1 jayson staff 1112 Mar 30 16:20 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.F05 -rw-r--r-- 1 jayson staff 1112 Mar 30 15:57 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.inp -rw-r--r-- 1 jayson staff 11883 Mar 30 16:22 .//data/queue/napthoquinone_DFT_321G/napthoquinone_DFT_321G.log Fri Mar 30 16:22:54 CDT 2012 0.075u 0.096s 2:02.11 0.1% 0+0k 83+17io 59pf+0w