t2run_m9.csh: Run job, Mod. 9 version January 21, 1999. t2run_m9.csh: Problem ID= 202308060009 t2run_m9.csh: IFILE= /home/opal/batch/input/202308060009.inp t2run_m9.csh: OFILE= /home/opal/batch/output/202308060009.tab t2run_m9.csh: LFILE= /home/opal/batch/log/202308060009.log t2run_m9.csh: BEG_GRP= sharp2@llnl.gov,iglesias1@llnl.gov t2run_m9.csh: END_GRP= sharp2@llnl.gov,iglesias1@llnl.gov t2run_m9.csh: ERR_GRP= sharp2@llnl.gov,iglesias1@llnl.gov t2run_m9.csh: Problem ID= 202308060009, user EMAIL= mattdell@fastmail.fm t2run_m9.csh: Sending start notification to sharp2@llnl.gov,iglesias1@llnl.gov ... t2run_m9.csh: Generating XYZ files... genxyz: Enter Z? 4.00000E-02 genxyz: Enter OPATH? /home/opal/batch/input genxyz: Enter PID? 202308060009 Linux dixie4.llnl.gov 3.10.0-1160.76.1.el7.x86_64 #1 SMP Tue Jul 26 14:15:37 UTC 2022 x86_64 x86_64 x86_64 GNU/Linux t2run_m9.csh: Start mixture calculation at Sun Aug 6 01:23:20 PDT 2023 t2run_m9.csh: Start mixture calculation for /home/opal/batch/input/202308060009.x00lst... automix: Failed to open "filnam8" input file. Reading "web site" parameters from standard input. automix: Input parameters... italk= 1 nxyzco= /home/opal/batch/input/202308060009.x00lst bpath= /home/opal/batch/data opath= /home/opal/batch/output pid= 202308060009 email= mattdell@fastmail.fm uname= University of Pisa comment= xnwtab: Opening INFILE= /home/opal/batch/data/binm8 xnwtab: Complete col= 1 Loop time (s.); cpu,elapsed= 1.1694E+00 1.1768E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm75 xnwtab: Complete col= 2 Loop time (s.); cpu,elapsed= 1.1681E+00 1.1694E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm7 xnwtab: Complete col= 3 Loop time (s.); cpu,elapsed= 1.1679E+00 1.1680E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm65 xnwtab: Complete col= 4 Loop time (s.); cpu,elapsed= 1.1700E+00 1.1699E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm6 xnwtab: Complete col= 5 Loop time (s.); cpu,elapsed= 1.1681E+00 1.1680E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm55 xnwtab: Complete col= 6 Loop time (s.); cpu,elapsed= 1.1681E+00 1.1680E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm5 xnwtab: Complete col= 7 Loop time (s.); cpu,elapsed= 1.1696E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm45 xnwtab: Complete col= 8 Loop time (s.); cpu,elapsed= 1.1681E+00 1.1680E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm4 xnwtab: Complete col= 9 Loop time (s.); cpu,elapsed= 1.1697E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm35 xnwtab: Complete col= 10 Loop time (s.); cpu,elapsed= 1.1720E+00 1.1724E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm3 xnwtab: Complete col= 11 Loop time (s.); cpu,elapsed= 1.1760E+00 1.1768E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm25 xnwtab: Complete col= 12 Loop time (s.); cpu,elapsed= 1.1820E+00 1.1821E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm2 xnwtab: Complete col= 13 Loop time (s.); cpu,elapsed= 1.1964E+00 1.1978E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm15 xnwtab: Complete col= 14 Loop time (s.); cpu,elapsed= 1.2151E+00 1.2163E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm1 xnwtab: Complete col= 15 Loop time (s.); cpu,elapsed= 1.2514E+00 1.2520E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm05 xnwtab: Complete col= 16 Loop time (s.); cpu,elapsed= 1.1379E+00 1.1377E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm0 xnwtab: Complete col= 17 Loop time (s.); cpu,elapsed= 1.3440E+00 1.3442E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp05 xnwtab: Complete col= 18 Loop time (s.); cpu,elapsed= 1.3309E+00 1.3311E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp1 xnwtab: Complete col= 19 Loop time (s.); cpu,elapsed= 1.3752E+00 1.3760E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp15 xnwtab: Complete col= 20 Loop time (s.); cpu,elapsed= 1.1241E+00 1.1240E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp2 xnwtab: Complete col= 21 Loop time (s.); cpu,elapsed= 3.4774E-01 3.4766E-01 xnwtab: Opening NEWTAB= /home/opal/batch/output/202308060009.x00tab automix: Total time (in s); elapsed,cpu= 2.4460E+01 2.4447E+01 total time= 2.4447E+01 t2run_m9.csh: Start mixture calculation for /home/opal/batch/input/202308060009.x03lst... automix: Failed to open "filnam8" input file. Reading "web site" parameters from standard input. automix: Input parameters... italk= 1 nxyzco= /home/opal/batch/input/202308060009.x03lst bpath= /home/opal/batch/data opath= /home/opal/batch/output pid= 202308060009 email= mattdell@fastmail.fm uname= University of Pisa comment= xnwtab: Opening INFILE= /home/opal/batch/data/binm8 xnwtab: Complete col= 1 Loop time (s.); cpu,elapsed= 1.1684E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm75 xnwtab: Complete col= 2 Loop time (s.); cpu,elapsed= 1.1685E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm7 xnwtab: Complete col= 3 Loop time (s.); cpu,elapsed= 1.1674E+00 1.1685E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm65 xnwtab: Complete col= 4 Loop time (s.); cpu,elapsed= 1.1691E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm6 xnwtab: Complete col= 5 Loop time (s.); cpu,elapsed= 1.1656E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm55 xnwtab: Complete col= 6 Loop time (s.); cpu,elapsed= 1.1661E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm5 xnwtab: Complete col= 7 Loop time (s.); cpu,elapsed= 1.1662E+00 1.1670E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm45 xnwtab: Complete col= 8 Loop time (s.); cpu,elapsed= 1.1661E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm4 xnwtab: Complete col= 9 Loop time (s.); cpu,elapsed= 1.1686E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm35 xnwtab: Complete col= 10 Loop time (s.); cpu,elapsed= 1.1705E+00 1.1699E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm3 xnwtab: Complete col= 11 Loop time (s.); cpu,elapsed= 1.1745E+00 1.1748E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm25 xnwtab: Complete col= 12 Loop time (s.); cpu,elapsed= 1.1812E+00 1.1821E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm2 xnwtab: Complete col= 13 Loop time (s.); cpu,elapsed= 1.1955E+00 1.1948E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm15 xnwtab: Complete col= 14 Loop time (s.); cpu,elapsed= 1.2164E+00 1.2173E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm1 xnwtab: Complete col= 15 Loop time (s.); cpu,elapsed= 1.2575E+00 1.2568E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm05 xnwtab: Complete col= 16 Loop time (s.); cpu,elapsed= 1.1435E+00 1.1431E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm0 xnwtab: Complete col= 17 Loop time (s.); cpu,elapsed= 1.3510E+00 1.3511E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp05 xnwtab: Complete col= 18 Loop time (s.); cpu,elapsed= 1.3436E+00 1.3438E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp1 xnwtab: Complete col= 19 Loop time (s.); cpu,elapsed= 1.3921E+00 1.3921E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp15 xnwtab: Complete col= 20 Loop time (s.); cpu,elapsed= 1.1365E+00 1.1372E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp2 xnwtab: Complete col= 21 Loop time (s.); cpu,elapsed= 3.4881E-01 3.4912E-01 xnwtab: Opening NEWTAB= /home/opal/batch/output/202308060009.x03tab automix: Total time (in s); elapsed,cpu= 2.4493E+01 2.4490E+01 total time= 2.4490E+01 t2run_m9.csh: Start mixture calculation for /home/opal/batch/input/202308060009.x10lst... automix: Failed to open "filnam8" input file. Reading "web site" parameters from standard input. automix: Input parameters... italk= 1 nxyzco= /home/opal/batch/input/202308060009.x10lst bpath= /home/opal/batch/data opath= /home/opal/batch/output pid= 202308060009 email= mattdell@fastmail.fm uname= University of Pisa comment= xnwtab: Opening INFILE= /home/opal/batch/data/binm8 xnwtab: Complete col= 1 Loop time (s.); cpu,elapsed= 1.1658E+00 1.1650E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm75 xnwtab: Complete col= 2 Loop time (s.); cpu,elapsed= 1.1659E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm7 xnwtab: Complete col= 3 Loop time (s.); cpu,elapsed= 1.1657E+00 1.1729E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm65 xnwtab: Complete col= 4 Loop time (s.); cpu,elapsed= 1.1665E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm6 xnwtab: Complete col= 5 Loop time (s.); cpu,elapsed= 1.1649E+00 1.1650E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm55 xnwtab: Complete col= 6 Loop time (s.); cpu,elapsed= 1.1659E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm5 xnwtab: Complete col= 7 Loop time (s.); cpu,elapsed= 1.1673E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm45 xnwtab: Complete col= 8 Loop time (s.); cpu,elapsed= 1.1659E+00 1.1660E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm4 xnwtab: Complete col= 9 Loop time (s.); cpu,elapsed= 1.1688E+00 1.1689E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm35 xnwtab: Complete col= 10 Loop time (s.); cpu,elapsed= 1.1715E+00 1.1714E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm3 xnwtab: Complete col= 11 Loop time (s.); cpu,elapsed= 1.1757E+00 1.1758E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm25 xnwtab: Complete col= 12 Loop time (s.); cpu,elapsed= 1.1834E+00 1.1841E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm2 xnwtab: Complete col= 13 Loop time (s.); cpu,elapsed= 1.1954E+00 1.1958E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm15 xnwtab: Complete col= 14 Loop time (s.); cpu,elapsed= 1.2178E+00 1.2183E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm1 xnwtab: Complete col= 15 Loop time (s.); cpu,elapsed= 1.2602E+00 1.2598E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm05 xnwtab: Complete col= 16 Loop time (s.); cpu,elapsed= 1.1453E+00 1.1460E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm0 xnwtab: Complete col= 17 Loop time (s.); cpu,elapsed= 1.3529E+00 1.3530E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp05 xnwtab: Complete col= 18 Loop time (s.); cpu,elapsed= 1.3451E+00 1.3452E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp1 xnwtab: Complete col= 19 Loop time (s.); cpu,elapsed= 1.3961E+00 1.3960E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp15 xnwtab: Complete col= 20 Loop time (s.); cpu,elapsed= 1.1394E+00 1.1392E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp2 xnwtab: Complete col= 21 Loop time (s.); cpu,elapsed= 3.4907E-01 3.4863E-01 xnwtab: Opening NEWTAB= /home/opal/batch/output/202308060009.x10tab automix: Total time (in s); elapsed,cpu= 2.4512E+01 2.4501E+01 total time= 2.4501E+01 t2run_m9.csh: Start mixture calculation for /home/opal/batch/input/202308060009.x35lst... automix: Failed to open "filnam8" input file. Reading "web site" parameters from standard input. automix: Input parameters... italk= 1 nxyzco= /home/opal/batch/input/202308060009.x35lst bpath= /home/opal/batch/data opath= /home/opal/batch/output pid= 202308060009 email= mattdell@fastmail.fm uname= University of Pisa comment= xnwtab: Opening INFILE= /home/opal/batch/data/binm8 xnwtab: Complete col= 1 Loop time (s.); cpu,elapsed= 1.0744E+00 1.0742E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm75 xnwtab: Complete col= 2 Loop time (s.); cpu,elapsed= 1.0755E+00 1.0757E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm7 xnwtab: Complete col= 3 Loop time (s.); cpu,elapsed= 1.0738E+00 1.0742E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm65 xnwtab: Complete col= 4 Loop time (s.); cpu,elapsed= 1.0746E+00 1.0747E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm6 xnwtab: Complete col= 5 Loop time (s.); cpu,elapsed= 1.0721E+00 1.0723E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm55 xnwtab: Complete col= 6 Loop time (s.); cpu,elapsed= 1.0719E+00 1.0718E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm5 xnwtab: Complete col= 7 Loop time (s.); cpu,elapsed= 1.0749E+00 1.0752E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm45 xnwtab: Complete col= 8 Loop time (s.); cpu,elapsed= 1.0750E+00 1.0762E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm4 xnwtab: Complete col= 9 Loop time (s.); cpu,elapsed= 1.0760E+00 1.0757E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm35 xnwtab: Complete col= 10 Loop time (s.); cpu,elapsed= 1.0791E+00 1.0791E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm3 xnwtab: Complete col= 11 Loop time (s.); cpu,elapsed= 1.0830E+00 1.0830E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm25 xnwtab: Complete col= 12 Loop time (s.); cpu,elapsed= 1.0906E+00 1.0908E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm2 xnwtab: Complete col= 13 Loop time (s.); cpu,elapsed= 1.1070E+00 1.1069E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm15 xnwtab: Complete col= 14 Loop time (s.); cpu,elapsed= 1.1314E+00 1.1323E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm1 xnwtab: Complete col= 15 Loop time (s.); cpu,elapsed= 1.1719E+00 1.1719E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm05 xnwtab: Complete col= 16 Loop time (s.); cpu,elapsed= 1.0654E+00 1.0649E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binm0 xnwtab: Complete col= 17 Loop time (s.); cpu,elapsed= 1.2792E+00 1.2803E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp05 xnwtab: Complete col= 18 Loop time (s.); cpu,elapsed= 1.2767E+00 1.2759E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp1 xnwtab: Complete col= 19 Loop time (s.); cpu,elapsed= 1.3360E+00 1.3359E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp15 xnwtab: Complete col= 20 Loop time (s.); cpu,elapsed= 1.0877E+00 1.0869E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp2 xnwtab: Complete col= 21 Loop time (s.); cpu,elapsed= 3.2465E-01 3.2520E-01 xnwtab: Opening NEWTAB= /home/opal/batch/output/202308060009.x35tab automix: Total time (in s); elapsed,cpu= 2.2765E+01 2.2763E+01 total time= 2.2763E+01 t2run_m9.csh: Start mixture calculation for /home/opal/batch/input/202308060009.x70lst... automix: Failed to open "filnam8" input file. Reading "web site" parameters from standard input. automix: Input parameters... italk= 1 nxyzco= /home/opal/batch/input/202308060009.x70lst bpath= /home/opal/batch/data opath= /home/opal/batch/output pid= 202308060009 email= mattdell@fastmail.fm uname= University of Pisa comment= xnwtab: Opening INFILE= /home/opal/batch/data/binm8 xnwtab: Complete col= 1 Loop time (s.); cpu,elapsed= 8.8190E-01 8.8184E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm75 xnwtab: Complete col= 2 Loop time (s.); cpu,elapsed= 8.8121E-01 8.8232E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm7 xnwtab: Complete col= 3 Loop time (s.); cpu,elapsed= 8.8233E-01 8.8184E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm65 xnwtab: Complete col= 4 Loop time (s.); cpu,elapsed= 8.8200E-01 8.8184E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm6 xnwtab: Complete col= 5 Loop time (s.); cpu,elapsed= 8.8380E-01 8.8428E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm55 xnwtab: Complete col= 6 Loop time (s.); cpu,elapsed= 8.8224E-01 8.8281E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm5 xnwtab: Complete col= 7 Loop time (s.); cpu,elapsed= 8.8190E-01 8.8184E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm45 xnwtab: Complete col= 8 Loop time (s.); cpu,elapsed= 8.8178E-01 8.8232E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm4 xnwtab: Complete col= 9 Loop time (s.); cpu,elapsed= 8.8363E-01 8.8281E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm35 xnwtab: Complete col= 10 Loop time (s.); cpu,elapsed= 8.8531E-01 8.8623E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm3 xnwtab: Complete col= 11 Loop time (s.); cpu,elapsed= 8.8813E-01 8.8770E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm25 xnwtab: Complete col= 12 Loop time (s.); cpu,elapsed= 8.9443E-01 8.9502E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm2 xnwtab: Complete col= 13 Loop time (s.); cpu,elapsed= 9.0519E-01 9.0527E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm15 xnwtab: Complete col= 14 Loop time (s.); cpu,elapsed= 9.2395E-01 9.2383E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm1 xnwtab: Complete col= 15 Loop time (s.); cpu,elapsed= 9.5889E-01 9.5898E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm05 xnwtab: Complete col= 16 Loop time (s.); cpu,elapsed= 8.7111E-01 8.7109E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binm0 xnwtab: Complete col= 17 Loop time (s.); cpu,elapsed= 1.0933E+00 1.0928E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp05 xnwtab: Complete col= 18 Loop time (s.); cpu,elapsed= 1.0864E+00 1.0874E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp1 xnwtab: Complete col= 19 Loop time (s.); cpu,elapsed= 1.1287E+00 1.1279E+00 xnwtab: Opening INFILE= /home/opal/batch/data/binp15 xnwtab: Complete col= 20 Loop time (s.); cpu,elapsed= 9.1697E-01 9.1797E-01 xnwtab: Opening INFILE= /home/opal/batch/data/binp2 xnwtab: Complete col= 21 Loop time (s.); cpu,elapsed= 2.6497E-01 2.6514E-01 xnwtab: Opening NEWTAB= /home/opal/batch/output/202308060009.x70tab automix: Total time (in s); elapsed,cpu= 1.8800E+01 1.8798E+01 total time= 1.8798E+01 t2run_m9.csh: End mixture calculation at Sun Aug 6 01:25:15 PDT 2023 t2run_m9.csh: End notification to sharp2@llnl.gov,iglesias1@llnl.gov ... t2run_m9.csh: User notification to mattdell@fastmail.fm ...