INFO: Using directory: "3" INFO: Using existing c-file: ./Test_SX.c INFO: Using existing binary: ./Test_SX.out INFO: === Simulation 'Test_SX' (/Users/peterwillendrup/tmp/mcstas-test/20240617_1000_29/mcstas-3.4.49_Darwin/Test_SX/Test_SX.instr): running on 10 nodes (master is 'CIN-969631', MPI version 3.1). [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize [Test_SX] Initialize Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] [Test_SX] Initialize Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Opening input file '/Users/peterwillendrup/miniforge3/share/mcstas/resources/data/YBaCuO.lau' (Table_Read_Offset) Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Mode: lengths and angles Single_crystal: YBaCuO.lau structure a=3.8186 b=3.886 c=11.6777 aa=90 bb=90 cc=90 V0=173.286 Single_crystal: SX: Read 62 reflections from file 'YBaCuO.lau' Single_crystal: SX: Vc=173.286 [Angs] sigma_abs=14.82 [barn] sigma_inc=2.105 [barn] reflections=YBaCuO.lau Direct space lattice orientation: a = [0 3.886 2.37949e-16] b = [0 0 3.8186] c = [11.6777 7.15053e-16 7.15053e-16] Reciprocal space lattice orientation: a* = [-9.90052e-17 1.61688 0] b* = [-1.00753e-16 -1.00753e-16 1.64542] c* = [0.53805 0 0] Trace ETA (10 MPI processes) 50 [s] 21 % 30 % 40 % 50 % 60 % 70 % 80 % 90 % *** TRACE end *** Save [Test_SX] Detector: PSD_I=4.0512e+09 PSD_ERR=1.28126e+06 PSD_N=5e+07 "incoming.dat" Detector: Full_mon_I=7.15971e+07 Full_mon_ERR=15495.2 Full_mon_N=4.995e+08 "FULL.dat" Detector: Sph_tun_I=0 Sph_tun_ERR=0 Sph_tun_N=0 "tun.dat" Detector: PSDBS_I=0 PSDBS_ERR=0 PSDBS_N=0 "BS0.dat" Detector: Sph_mon_I=7.15971e+07 Sph_mon_ERR=15495.2 Sph_mon_N=4.995e+08 "Tot.dat" Detector: Sph_coh_I=2.62344e+07 Sph_coh_ERR=14549.6 Sph_coh_N=1.38584e+07 "coh.dat" Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Detector: Sph_inc_I=4.53627e+07 Sph_inc_ERR=5330.11 Sph_inc_N=4.85642e+08 "inc.dat" Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] Finally [Test_SX: 3]. Time: 47 [s] INFO: Placing instr file copy /Users/peterwillendrup/tmp/mcstas-test/20240617_1000_29/mcstas-3.4.49_Darwin/Test_SX/Test_SX.instr in dataset 3