INFO: Using directory: "7" INFO: Using existing c-file: ./Test_PowderN.c INFO: Using existing binary: ./Test_PowderN.out WARNING: Ignoring invalid parameter: "Test_PowderN.instr" INFO: === Simulation 'Test_PowderN' (/home/nexmap/pkwi/xTESTS/2022-07-01/McXtrace-1.x_CPU_MPICC_5e7/Test_PowderN/Test_PowderN.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). [Test_PowderN] Initialize Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/1.x-dev/tools/Python/mxrun/../mccodelib/../../../data/LaB6_660b_AVID2.hkl' (Table_Read_Offset) [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize [Test_PowderN] Initialize Table from file 'LaB6_660b_AVID2.hkl' (block 1) is 1453 x 6 (x=1:23), constant step. interpolation: linear '# TITLE La1 B6 [Cubic, Centric (-1 at origin)];# a b ...' PowderN: Pow: Reading 1453 rows from LaB6_660b_AVID2.hkl PowderN: Pow: Powder file probably of type Crystallographica/Fullprof (lau) WARNING: but F2 unit is set to barns=1 (barns). Intensity might be 100 times too high. PowderN: Pow: Read 1453 reflections from file 'LaB6_660b_AVID2.hkl' PowderN: Pow: WARNING: You have requested statistics for incoherent scattering but not set a material datafile ('') nor defined sigma_inc! PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . PowderN: Pow Error reading material data from file . Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 20 [s] % 53 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 19 [s] % 55 Trace ETA 20 [s] % 54 Trace ETA 19 [s] % 55 65 65 65 65 65 65 65 65 65 65 65 65 65 65 64 63 PowderN: Pow: WARNING: Did not hit sample from inside (coh). ABSORB. 75 75 75 75 75 75 75 75 75 75 75 75 75 75 74 73 PowderN: Pow: WARNING: Did not hit sample from inside (coh). ABSORB. 85 85 85 85 85 85 85 85 85 85 85 85 85 85 84 83 95 95 95 95 95 95 95 95 95 95 95 95 95 95 94 93 Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22424e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.23054e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22982e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22432e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.2311e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.23331e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22336e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22116e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22407e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22104e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 19 [s] Warning: 3.22099e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Save [Test_PowderN] Detector: Sph_mon_I=7.94385e-10 Sph_mon_ERR=3.3023e-14 Sph_mon_N=1e+09 "Sphere.dat" Finally [Test_PowderN: 7]. Time: 20 [s] Warning: 3.21722e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 20 [s] Warning: 3.22568e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 20 [s] Warning: 3.21209e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Finally [Test_PowderN: 7]. Time: 20 [s] Warning: 3.22408e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). Detector: detector2_I=7.88169e-10 detector2_ERR=3.29882e-14 detector2_N=9.10018e+08 "psd2.dat" Finally [Test_PowderN: 7]. Time: 20 [s] PowderN: Pow: Info: you may highly improve the computation efficiency by using SPLIT 144 COMPONENT Pow=PowderN(...) in the instrument description /home/nexmap/pkwi/xTESTS/2022-07-01/McXtrace-1.x_CPU_MPICC_5e7/Test_PowderN/Test_PowderN.instr. Warning: 3.21712e+06 events were removed in Component[7] detector2=PSD_monitor() (negative time, miss next components, rounding errors, Nan, Inf). INFO: Placing instr file copy /home/nexmap/pkwi/xTESTS/2022-07-01/McXtrace-1.x_CPU_MPICC_5e7/Test_PowderN/Test_PowderN.instr in dataset 7 loading system configuration loading override configuration from /home/nexmap/pkwi/mxtest/mctest/../mccodelib/mcxtrace-test/McXtrace-1.x_CPU_MPICC/mccode_config.json