INFO: Using directory: "1" INFO: Using existing c-file: ./MAXII_811.c INFO: Using existing binary: ./MAXII_811.out WARNING: Ignoring invalid parameter: "MAXII_811.instr" INFO: === Simulation 'MAXII_811' (/home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace_CPU_MPICC_KISS_5e7/MAXII_811/MAXII_811.instr): running on 16 nodes (master is 'elearn1.fysik.dtu.dk', MPI version 3.1). [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize [MAXII_811] Initialize Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/characteristics_wiggler811.dc0' (Table_Read_Offset) [MAXII_811] Initialize INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] INFO (wiggler): Integrated intensity radiated is 4.54764e+15 pht/s wiggler: E0!=0 -> assuming intensity spectrum is parametrized by energy [keV] Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/C.txt' (Table_Read_Offset) WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Rh.txt' (Table_Read_Offset) fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. fe_c_filter: Rebinning material data (C.txt) for faster tracing...done fe_c_filter: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Reusing input file 'C.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. c_filter: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter1: Rebinning material data (C.txt) for faster tracing...done Reusing input file 'C.txt' (Table_Read_Offset) att_filter2: Rebinning material data (C.txt) for faster tracing...done Reusing input file 'C.txt' (Table_Read_Offset) att_filter3: Rebinning material data (C.txt) for faster tracing...done Reusing input file 'C.txt' (Table_Read_Offset) c_filter: Rebinning material data (C.txt) for faster tracing...done Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Si.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from C.txt would exceed 1M rows. Skipping. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. att_filter1: Rebinning material data (C.txt) for faster tracing...done att_filter2: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done att_filter3: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done c_filter: Rebinning material data (C.txt) for faster tracing...done Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/FormFactors.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Reusing input file 'Si.txt' (Table_Read_Offset) Reusing input file 'FormFactors.txt' (Table_Read_Offset) Reusing input file 'Rh.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Be.txt' (Table_Read_Offset) INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. INFO (reflectivity-lib): Datafile type not explicit in reflectivity file. Inferring type COATING from datafile. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. be_window: Rebinning material data (Be.txt) for faster tracing...done be_window: Rebinning material data (Be.txt) for faster tracing...done Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Ag.txt' (Table_Read_Offset) Warning: xafs_sample: Invalid inner volume specification. Ignoring. Warning: xafs_sample: Invalid inner volume specification. Ignoring. WARNING: (Table_Rebin): Rebinning table from Be.txt would exceed 1M rows. Skipping. Warning: xafs_sample: Invalid inner volume specification. Ignoring. INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Fe.txt' (Table_Read_Offset) INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt INFO: xafs_sample: Setting rho_o=10.48 from Ag.txt WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done xafs_ref_sample: Rebinning material data (Fe.txt) for faster tracing...done Opening input file '/home/nexmap/pkwi/McXtrace/mcxtrace/3.x-dev/data/Si.laz' (Table_Read_Offset) WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability WARNING: (Table_Rebin): Rebinning table from Fe.txt would exceed 1M rows. Skipping. PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability PowderN: si_sample: WARNING: p_interact=0, adjusting to 0.01, to avoid algorithm instability Table from file 'Si.laz' (block 1) is 45 x 18 (x=1:10), constant step. interpolation: linear '# TITLE *-Si-[FD3-MS] Toebbens, D.M.;Stuesser, N.;Knorr, K.;Mayer[2001];# C ...' PowderN: si_sample: Reading 45 rows from Si.laz PowderN: si_sample: Read 45 reflections from file 'Si.laz' PowderN: si_sample: WARNING: You have requested statistics for incoherent scattering but not set a material datafile ('Si.txt') nor defined sigma_inc! Reusing input file 'Si.txt' (Table_Read_Offset) Trace ETA 2 [s] % 544 Trace ETA 0 [s] % 1442 Trace ETA 25 [s] % 43 Trace ETA 1 [s] % 944 Trace ETA 0 [s] % 1343 Trace ETA 3 [s] % 344 Trace ETA 1 [s] % 643 Trace ETA 7 [s] % 143 Trace ETA 1 [s] % 1043 Trace ETA 1 [s] % 743 Trace ETA 2 [s] % 443 Trace ETA 0 [s] % 1243 Trace ETA 4 [s] % 242 Trace ETA 0 [s] % 1543 Trace ETA 0 [s] % 1142 Trace ETA 1 [s] % 844 950 550 350 850 750 50 1050 450 150 1350 650 1550 1250 1450 250 1150 960 560 360 860 760 60 1060 160 460 1360 660 1560 1260 1460 260 1160 970 570 370 870 770 70 1070 170 470 1370 670 1570 1270 1470 270 1170 980 580 380 880 780 80 1080 180 480 1380 680 1580 1280 1480 280 1180 990 590 390 890 790 90 1090 190 490 1390 690 1590 1290 1490 290 1190 *** TRACE end *** Save [MAXII_811] Detector: source_psd_I=4.55524e+15 source_psd_ERR=6.62594e+11 source_psd_N=5e+07 "source.psd" Detector: source_E_I=4.5514e+15 source_E_ERR=6.6256e+11 source_E_N=4.95879e+07 "source.E" Detector: source_L_I=4.5514e+15 source_L_ERR=6.6256e+11 source_L_N=4.95879e+07 "source.L" Detector: m_entry_psd_I=2.98875e+15 m_entry_psd_ERR=5.21709e+11 m_entry_psd_N=3.92869e+07 "me_psd.dat" Detector: m_entry_E_I=2.98873e+15 m_entry_E_ERR=5.21709e+11 m_entry_E_N=3.89629e+07 "m_entry.E" Detector: m_entry_L_I=2.98873e+15 m_entry_L_ERR=5.21709e+11 m_entry_L_N=3.89629e+07 "m_entry.L" Detector: hutch_psd_I=3.49999e+10 hutch_psd_ERR=1.44518e+09 hutch_psd_N=5.50815e+06 "hutch_psd.dat" Detector: hutch_E_I=2.18235e+11 hutch_E_ERR=3.6101e+09 hutch_E_N=65730 "hutch.E" Detector: hutch_E2_I=1.03937e+11 hutch_E2_ERR=2.48794e+09 hutch_E2_N=1.55829e+07 "hutch2.E2" Detector: hucth_L_I=2.18232e+11 hucth_L_ERR=3.61009e+09 hucth_L_N=68690 "hutch.L" Detector: I0_I=0 I0_ERR=0 I0_N=0 "I0" Detector: I1_I=0 I1_ERR=0 I1_N=0 "I1" Detector: I2_I=0 I2_ERR=0 I2_N=0 "I2" Detector: diff_sample_psd_I=1.17215e+10 diff_sample_psd_ERR=8.40079e+08 diff_sample_psd_N=1.86997e+06 "diff_sample_psd.dat" Detector: sphere_psd_I=1.87282e+08 sphere_psd_ERR=1.6877e+07 sphere_psd_N=4.26061e+07 "sphere_psd.dat" Detector: square_psd_I=8.69725e+06 square_psd_ERR=2.18633e+06 square_psd_N=6.78131e+06 "square_psd.dat" Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Finally [MAXII_811: 1]. Time: 25 [s] Detector: pilatus100k_I=0 pilatus100k_ERR=0 pilatus100k_N=6050 "pil_diff.psd" Finally [MAXII_811: 1]. Time: 25 [s] INFO: Placing instr file copy /home/nexmap/pkwi/xTESTS/2023-12-20/McXtrace_CPU_MPICC_KISS_5e7/MAXII_811/MAXII_811.instr in dataset 1