INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_H5.c INFO: Using existing binary: ./ILL_H5.out INFO: === Simulation 'ILL_H5' (ILL_H5.instr): running on 2 nodes (master is 'sjc20-cw715-56decdc7-cd41-4df3-9fe5-4d96d83bc84e-2E412DA75231.local', MPI version 3.1). ILL_H5: IN14: A1=38.7506 [deg] RMV=2.02467 [m] lambda=4.2 [Angs] sample=Rb_liq_coh.sqw ILL_H5: IN16: A1=69.8672 [deg] RMV=2.01006 [m] lambda=6.3 [Angs] sample=Rb_liq_coh.sqw ILL_H5: D16: A1=56.5716 [deg] RMV=3.02043 [m] lambda=5.6 [Angs] sample=H2O_liq.qSq ILL_H5: SuperADAM: A1=40.9756 [deg] RMV=2.90659 [m] lambda=4.4 [Angs] sample=SiO2_quartza.laz ILL_H5: IN15: nu=26129.9 [rmp] lambda=6.5 [Angs] sample=Vanadium (polarized) ILL_H5: D22: nu=28307.4 [rpm] lambda=4.5 [Angs] sample=H2O_liq.qSq ILL_H5: IN14: A1=38.7506 [deg] RMV=2.02467 [m] lambda=4.2 [Angs] sample=Rb_liq_coh.sqw ILL_H5: IN16: A1=69.8672 [deg] RMV=2.01006 [m] lambda=6.3 [Angs] sample=Rb_liq_coh.sqw ILL_H5: D16: A1=56.5716 [deg] RMV=3.02043 [m] lambda=5.6 [Angs] sample=H2O_liq.qSq ILL_H5: SuperADAM: A1=40.9756 [deg] RMV=2.90659 [m] lambda=4.4 [Angs] sample=SiO2_quartza.laz ILL_H5: IN15: nu=26129.9 [rmp] lambda=6.5 [Angs] sample=Vanadium (polarized) ILL_H5: D22: nu=28307.4 [rpm] lambda=4.5 [Angs] sample=H2O_liq.qSq [ILL_H5] Initialize Source_gen: component HCS (square 0.1 x 0.1) focusing distance dist=2.155 area=0.123 x 0.12 spectra 0.500 to 9.500 AA (0.906 to 327.240 meV) T1=40.1 K (4.865 AA), T2=145.8 K (2.552 AA), T3=413.5 K (1.515 AA) Flux is dPhi/dlambda in [n/s/cm2]. [ILL_H5] Initialize Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al: Reading 26 rows from Al.laz PowderN: HCS_Al: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_4: Reading 26 rows from Al.laz PowderN: HCS_Al_4: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_4: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_5: Reading 26 rows from Al.laz PowderN: HCS_Al_5: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_5: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_6: Reading 26 rows from Al.laz PowderN: HCS_Al_6: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_6: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_7: Reading 26 rows from Al.laz PowderN: HCS_Al_7: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_7: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: H53_Al: Reading 26 rows from Al.laz PowderN: H53_Al: Read 26 reflections from file 'Al.laz' PowderN: H53_Al: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_15: Reading 26 rows from Al.laz PowderN: HCS_Al_15: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_15: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_19: Reading 26 rows from Al.laz PowderN: HCS_Al_19: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_19: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_21: Reading 26 rows from Al.laz PowderN: HCS_Al_21: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_21: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_23: Reading 26 rows from Al.laz PowderN: HCS_Al_23: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_23: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/HOPG.rfl' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/HOPG.trm' (Table_Read_Offset) Isotropic_Sqw: H53_IN14_Sample: is a cylinder: radius=0.005000 thickness=0.000000 height=0.050000 [J Comp Phys 228 (2009) 5251] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Isotropic_Sqw: H53_IN14_Sample: Temperature set to T=350 [K] Isotropic_Sqw: H53_IN14_Sample: S(q,w) data from Rb_liq_coh.sqw (coh) assumed to be classical (symmetrised in energy). Isotropic_Sqw: H53_IN14_Sample: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_coh.sqw file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: H53_IN14_Sample: Generated Rb_liq_coh.sqw coherent Sqw q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.887933 size=[101x10185] sigma=6.32 [barns] normalization factor S(q,w)*0.477012 (auto) \int q^2 S(q) dq=698.369 Isotropic_Sqw: H53_IN14_Sample: Using Isotropic elastic incoherent scattering (sigma=0.5 [barns]) Isotropic_Sqw: H53_IN14_Sample: Focusing can only apply for single scattering. Setting to order=1. Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_42: Reading 26 rows from Al.laz PowderN: HCS_Al_42: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_42: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_54: Reading 26 rows from Al.laz PowderN: HCS_Al_54: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_54: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_56: Reading 26 rows from Al.laz PowderN: HCS_Al_56: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_56: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_76: Reading 26 rows from Al.laz PowderN: HCS_Al_76: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_76: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Reusing input file 'HOPG.rfl' (Table_Read_Offset) Isotropic_Sqw: H53_IN16_Sample: is a cylinder: radius=0.005000 thickness=0.000000 height=0.050000 [J Comp Phys 228 (2009) 5251] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Rb_liq_coh.sqw' (Table_Read_Offset) Isotropic_Sqw: H53_IN16_Sample: Temperature set to T=350 [K] Isotropic_Sqw: H53_IN16_Sample: S(q,w) data from Rb_liq_coh.sqw (coh) assumed to be classical (symmetrised in energy). Isotropic_Sqw: H53_IN16_Sample: Applying exp(hw/2kT) factor with T=350 [K] on Rb_liq_coh.sqw file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: H53_IN16_Sample: Generated Rb_liq_coh.sqw coherent Sqw q=[0.1:10 Angs-1] w=[0:101.849 meV] |S|=0.887933 size=[101x10185] sigma=6.32 [barns] normalization factor S(q,w)*0.477012 (auto) \int q^2 S(q) dq=698.369 Isotropic_Sqw: H53_IN16_Sample: Using Isotropic elastic incoherent scattering (sigma=0.5 [barns]) Isotropic_Sqw: H53_IN16_Sample: Focusing can only apply for single scattering. Setting to order=1. Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_88: Reading 26 rows from Al.laz PowderN: HCS_Al_88: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_88: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_91: Reading 26 rows from Al.laz PowderN: HCS_Al_91: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_91: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Reusing input file 'HOPG.rfl' (Table_Read_Offset) Isotropic_Sqw: H53_D16_Sample: is a cylinder: radius=0.005000 thickness=0.000000 height=0.050000 [J Comp Phys 228 (2009) 5251] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/H2O_liq.qSq' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/H2O_liq.qSq' (Table_Read_Offset) Isotropic_Sqw: H53_D16_Sample: Computing scattering unit density V_rho=0.0332279 [AA^-3] from density=0.994 [g/cm^3] weight=18.015 [g/mol]. Isotropic_sqw: Converting 150 S(q) from H2O_liq.qSq into S(q,w) data Isotropic_sqw: q range [0:14.8], creating 150 elements vector Isotropic_Sqw: H53_D16_Sample: Temperature set to T=293 [K] Isotropic_Sqw: H53_D16_Sample: Applying exp(hw/2kT) factor with T=293 [K] on H2O_liq.qSq file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: H53_D16_Sample: Generated H2O_liq.qSq coherent Sqw q=[0:14.8 Angs-1] w=[0:0 meV] |S|=1.49025 size=[152x1] sigma=7.751 [barns] Mainly elastic scattering. Isotropic_Sqw: H53_D16_Sample: Using Isotropic elastic incoherent scattering (sigma=160.521 [barns]) Isotropic_Sqw: H53_D16_Sample: Focusing can only apply for single scattering. Setting to order=1. Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_104: Reading 26 rows from Al.laz PowderN: HCS_Al_104: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_104: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_107: Reading 26 rows from Al.laz PowderN: HCS_Al_107: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_107: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Reusing input file 'HOPG.rfl' (Table_Read_Offset) Isotropic_Sqw: H53_SADAM_Sample: is a cylinder: radius=0.005000 thickness=0.000000 height=0.050000 [J Comp Phys 228 (2009) 5251] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/SiO2_quartza.laz' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/SiO2_quartza.laz' (Table_Read_Offset) Isotropic_sqw: Converting 625 powder lines from SiO2_quartza.laz into S(q,w) data Isotropic_sqw: q range [0:12.4939], creating 25254 elements vector Isotropic_Sqw: H53_SADAM_Sample: Generated SiO2_quartza.laz coherent Sqw q=[0:12.4934 Angs-1] w=[0:0 meV] |S|=0.00187179 size=[25254x1] sigma=31.875 [barns] Mainly elastic scattering. Isotropic_Sqw: H53_SADAM_Sample: Using Isotropic elastic incoherent scattering (sigma=0.0168 [barns]) Isotropic_Sqw: H53_SADAM_Sample: Sample temperature not defined (T=0). Warning Disabling detailed balance. Isotropic_Sqw: H53_SADAM_Sample: Focusing can only apply for single scattering. Setting to order=1. Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_120: Reading 26 rows from Al.laz PowderN: HCS_Al_120: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_120: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_123: Reading 26 rows from Al.laz PowderN: HCS_Al_123: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_123: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_139: Reading 26 rows from Al.laz PowderN: HCS_Al_139: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_139: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_146: Reading 26 rows from Al.laz PowderN: HCS_Al_146: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_146: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_148: Reading 26 rows from Al.laz PowderN: HCS_Al_148: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_148: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_H51: Reading 26 rows from Al.laz PowderN: HCS_Al_H51: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_H51: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_165: Reading 26 rows from Al.laz PowderN: HCS_Al_165: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_165: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_167: Reading 26 rows from Al.laz PowderN: HCS_Al_167: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_167: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Incoherent: H511_IN15_Sample: Vc=13.827 [Angs] sigma_abs=5.08 [barn] sigma_inc=5.08 [barn] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_H512: Reading 26 rows from Al.laz PowderN: HCS_Al_H512: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_H512: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_199: Reading 26 rows from Al.laz PowderN: HCS_Al_199: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_199: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_204: Reading 26 rows from Al.laz PowderN: HCS_Al_204: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_204: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/Al.laz' (Table_Read_Offset) Table from file 'Al.laz' (block 1) is 26 x 18 (x=1:8), constant step. interpolation: linear '# TITLE *Aluminum-Al-[FM3-M] Miller, H.P.jr.;DuMond, J.W.M.[1942] at 298 K; ...' PowderN: HCS_Al_206: Reading 26 rows from Al.laz PowderN: HCS_Al_206: Read 26 reflections from file 'Al.laz' PowderN: HCS_Al_206: Vc=66.4 [Angs] sigma_abs=0.924 [barn] sigma_inc=0.0328 [barn] reflections=Al.laz Isotropic_Sqw: H51_D22_Sample: is a cylinder: radius=0.005000 thickness=0.000000 height=0.050000 [J Comp Phys 228 (2009) 5251] Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/H2O_liq.qSq' (Table_Read_Offset) Opening input file '/Users/runner/miniconda3/envs/mcstas/share/mcstas/resources/data/H2O_liq.qSq' (Table_Read_Offset) Isotropic_Sqw: H51_D22_Sample: Computing scattering unit density V_rho=0.0332279 [AA^-3] from density=0.994 [g/cm^3] weight=18.015 [g/mol]. Isotropic_sqw: Converting 150 S(q) from H2O_liq.qSq into S(q,w) data Isotropic_sqw: q range [0:14.8], creating 150 elements vector Isotropic_Sqw: H51_D22_Sample: Temperature set to T=293 [K] Isotropic_Sqw: H51_D22_Sample: Applying exp(hw/2kT) factor with T=293 [K] on H2O_liq.qSq file (classical/symmetric) using 'Frommhold' quantum correction Isotropic_Sqw: H51_D22_Sample: Generated H2O_liq.qSq coherent Sqw q=[0:14.8 Angs-1] w=[0:0 meV] |S|=1.49025 size=[152x1] sigma=7.751 [barns] Mainly elastic scattering. Isotropic_Sqw: H51_D22_Sample: Using Isotropic elastic incoherent scattering (sigma=160.521 [barns]) Isotropic_Sqw: H51_D22_Sample: Focusing can only apply for single scattering. Setting to order=1. *** TRACE end *** Save [ILL_H5] Detector: H5_I=7.45203e+13 H5_ERR=1.22195e+11 H5_N=772767 "H5_1765511297.x_y" Detector: H53_origin_I=1.83929e+13 H53_origin_ERR=6.07428e+10 H53_origin_N=188803 "H53_origin_1765511297.hd_vd" Detector: H52_origin_I=4.61368e+12 H52_origin_ERR=3.04316e+10 H52_origin_N=47386 "H52_origin_1765511297.hd_vd" Detector: H51_origin_I=1.21925e+13 H51_origin_ERR=4.94847e+10 H51_origin_N=125384 "H51_origin_1765511297.hd_vd" Detector: H53_Obt_Out_I=1.59153e+12 H53_Obt_Out_ERR=1.70175e+10 H53_Obt_Out_N=102524 "H53_Obt_Out_1765511297.x_y" Detector: H53_IN14_Monochromator_Cradle_I=7.69748e+11 H53_IN14_Monochromator_Cradle_ERR=1.0579e+10 H53_IN14_Monochromator_Cradle_N=82409 "H53_IN14_Monochromator_Cradle_1765511297.x_y" Detector: H53_IN14_Sample_Div_I=4.84238e+09 H53_IN14_Sample_Div_ERR=1.04939e+09 H53_IN14_Sample_Div_N=76 "H53_IN14_Sample_Div_1765511297.hd_vd" Detector: H53_IN14_Sample_XY_I=7.47295e+09 H53_IN14_Sample_XY_ERR=1.22901e+09 H53_IN14_Sample_XY_N=200 "H53_IN14_Sample_XY_1765511297.x_y" Detector: H53_IN14_Sample_L_I=7.47293e+09 H53_IN14_Sample_L_ERR=1.22904e+09 H53_IN14_Sample_L_N=197 "H53_IN14_Sample_L_1765511297.L" Detector: H53_IN14_Spectrometer_I=0 H53_IN14_Spectrometer_ERR=0 H53_IN14_Spectrometer_N=0 "H53_IN14_Spectrometer_1765511297.A_E" Detector: H53_IN14_Diffractometer_I=0 H53_IN14_Diffractometer_ERR=0 H53_IN14_Diffractometer_N=0 "H53_IN14_Diffractometer_1765511297.th_y" Detector: He3H_I=0 He3H_ERR=0 He3H_N=0 "He3H.dat" Detector: H53_VTE_I=5.08942e+11 H53_VTE_ERR=7.43867e+09 H53_VTE_N=62859 "H53_VTE_1765511297.x_y" Detector: H53_IN16_Monochromator_Cradle_I=4.1244e+11 H53_IN16_Monochromator_Cradle_ERR=6.68544e+09 H53_IN16_Monochromator_Cradle_N=49985 "H53_IN16_Monochromator_Cradle_1765511297.x_y" Detector: H53_IN16_Sample_Div_I=6.93375e+08 H53_IN16_Sample_Div_ERR=1.55119e+08 H53_IN16_Sample_Div_N=59 "H53_IN16_Sample_Div_1765511297.hd_vd" Detector: H53_IN16_Sample_XY_I=2.70594e+09 H53_IN16_Sample_XY_ERR=5.51511e+08 H53_IN16_Sample_XY_N=180 "H53_IN16_Sample_XY_1765511297.x_y" Detector: H53_IN16_Sample_L_I=2.70591e+09 H53_IN16_Sample_L_ERR=5.51523e+08 H53_IN16_Sample_L_N=178 "H53_IN16_Sample_L_1765511297.L" Detector: H53_IN16_Spectrometer_I=0 H53_IN16_Spectrometer_ERR=0 H53_IN16_Spectrometer_N=0 "H53_IN16_Spectrometer_1765511298.A_E" Detector: H53_IN16_Diffractometer_I=0 H53_IN16_Diffractometer_ERR=0 H53_IN16_Diffractometer_N=0 "H53_IN16_Diffractometer_1765511298.th_y" Detector: H53_D16_Monochromator_Cradle_I=3.7364e+11 H53_D16_Monochromator_Cradle_ERR=6.72005e+09 H53_D16_Monochromator_Cradle_N=38027 "H53_D16_Monochromator_Cradle_1765511298.x_y" Detector: H53_D16_Sample_Div_I=1.31185e+09 H53_D16_Sample_Div_ERR=4.98304e+08 H53_D16_Sample_Div_N=33 "H53_D16_Sample_Div_1765511298.hd_vd" Detector: H53_D16_Sample_XY_I=2.37842e+09 H53_D16_Sample_XY_ERR=6.02413e+08 H53_D16_Sample_XY_N=89 "H53_D16_Sample_XY_1765511298.x_y" Detector: H53_D16_Sample_L_I=2.37842e+09 H53_D16_Sample_L_ERR=6.02413e+08 H53_D16_Sample_L_N=89 "H53_D16_Sample_L_1765511298.L" Detector: H53_D16_Detector_I=0 H53_D16_Detector_ERR=0 H53_D16_Detector_N=0 "H53_D16_Detector_1765511298.x_y" Detector: H53_D16_Spectrometer_I=3.70291e+07 H53_D16_Spectrometer_ERR=2.58552e+07 H53_D16_Spectrometer_N=5 "H53_D16_Spectrometer_1765511298.A_E" Detector: H53_D16_Diffractometer_I=3.48994e+07 H53_D16_Diffractometer_ERR=2.60508e+07 H53_D16_Diffractometer_N=4 "H53_D16_Diffractometer_1765511298.th_y" Detector: H53_SADAM_Monochromator_Cradle_I=3.38687e+11 H53_SADAM_Monochromator_Cradle_ERR=6.72301e+09 H53_SADAM_Monochromator_Cradle_N=29135 "H53_SADAM_Monochromator_Cradle_1765511298.x_y" Detector: H53_SADAM_Sample_Div_I=1.28025e+09 H53_SADAM_Sample_Div_ERR=5.60262e+08 H53_SADAM_Sample_Div_N=17 "H53_SADAM_Sample_Div_1765511298.hd_vd" Detector: H53_SADAM_Sample_XY_I=3.27172e+09 H53_SADAM_Sample_XY_ERR=8.47264e+08 H53_SADAM_Sample_XY_N=51 "H53_SADAM_Sample_XY_1765511298.x_y" Detector: H53_SADAM_Sample_L_I=3.27172e+09 H53_SADAM_Sample_L_ERR=8.47264e+08 H53_SADAM_Sample_L_N=51 "H53_SADAM_Sample_L_1765511298.L" Detector: H53_SADAM_Detector_I=0 H53_SADAM_Detector_ERR=0 H53_SADAM_Detector_N=0 "H53_SADAM_Detector_1765511299.x_y" Detector: H53_SADAM_Spectrometer_I=0 H53_SADAM_Spectrometer_ERR=0 H53_SADAM_Spectrometer_N=0 "H53_SADAM_Spectrometer_1765511299.A_E" Detector: H53_SADAM_Diffractometer_I=0 H53_SADAM_Diffractometer_ERR=0 H53_SADAM_Diffractometer_N=0 "H53_SADAM_Diffractometer_1765511299.th_y" Detector: H53_CryoEDM_In_L_I=3.06253e+11 H53_CryoEDM_In_L_ERR=6.75418e+09 H53_CryoEDM_In_L_N=20571 "H53_CryoEDM_In_L_1765511299.L" Detector: H53_CryoEDM_mirror_ReflectXY_I=8.286e+09 H53_CryoEDM_mirror_ReflectXY_ERR=3.61528e+08 H53_CryoEDM_mirror_ReflectXY_N=2136 "H53_CryoEDM_mirror_ReflectXY.dat" Detector: H53_CryoEDM_mirror_TransmitXY_I=6.3475e+10 H53_CryoEDM_mirror_TransmitXY_ERR=1.37519e+10 H53_CryoEDM_mirror_TransmitXY_N=120 "H53_CryoEDM_mirror_TransmitXY.dat" Detector: H53_CryoEDM_Sample_L_I=1.27887e+10 H53_CryoEDM_Sample_L_ERR=4.39712e+08 H53_CryoEDM_Sample_L_N=5124 "H53_CryoEDM_Sample_L_1765511299.L" Detector: H53_CryoEDM_Sample_Div_I=1.27203e+10 H53_CryoEDM_Sample_Div_ERR=4.38986e+08 H53_CryoEDM_Sample_Div_N=3995 "H53_CryoEDM_Sample_Div_1765511299.hd_vd" Detector: H53_CryoEDM_Sample_XY_I=1.27887e+10 H53_CryoEDM_Sample_XY_ERR=4.39712e+08 H53_CryoEDM_Sample_XY_N=5131 "H53_CryoEDM_Sample_XY_1765511299.x_y" Detector: H52_Obt_Out_I=1.58092e+11 H52_Obt_Out_ERR=4.87944e+09 H52_Obt_Out_N=13234 "H52_Obt_Out_1765511299.x_y" Detector: H51_Obt_Out_I=4.76462e+11 H51_Obt_Out_ERR=8.56945e+09 H51_Obt_Out_N=37696 "H51_Obt_Out_1765511299.x_y" Detector: H51_S2_Out_I=3.50879e+11 H51_S2_Out_ERR=7.43836e+09 H51_S2_Out_N=31286 "H51_S2_Out_1765511299.x_y" Detector: H51_split_2_I=1.67121e+11 H51_split_2_ERR=5.1854e+09 H51_split_2_N=14329 "H51_split_2_1765511299.x_y" Detector: H51_split_1_I=1.58026e+11 H51_split_1_ERR=4.97537e+09 H51_split_1_N=14290 "H51_split_1_1765511299.x_y" Detector: H511_mirror_ReflectXY_I=1.47621e+10 H511_mirror_ReflectXY_ERR=4.8715e+08 H511_mirror_ReflectXY_N=4170 "H511_mirror_ReflectXY.dat" Detector: H511_mirror_TransmitXY_I=1.16568e+11 H511_mirror_TransmitXY_ERR=2.12529e+10 H511_mirror_TransmitXY_N=212 "H511_mirror_TransmitXY.dat" Detector: H511_mirror_outdXY_I=1.47621e+10 H511_mirror_outdXY_ERR=4.8715e+08 H511_mirror_outdXY_N=4153 "H511_mirror_outdXY_1765511299.hd_vd" Detector: H511_VTE_I=1.15672e+10 H511_VTE_ERR=4.51564e+08 H511_VTE_N=4237 "H511_VTE_1765511299.x_y" Detector: H511_IN15_Sample_Div_I=1.97976e+08 H511_IN15_Sample_Div_ERR=4.60025e+07 H511_IN15_Sample_Div_N=61 "H511_IN15_Sample_Div_1765511299.hd_vd" Detector: H511_IN15_Sample_XY_I=1.97976e+08 H511_IN15_Sample_XY_ERR=4.60025e+07 H511_IN15_Sample_XY_N=61 "H511_IN15_Sample_XY_1765511299.x_y" Detector: H511_IN15_Sample_L_I=1.97976e+08 H511_IN15_Sample_L_ERR=4.60025e+07 H511_IN15_Sample_L_N=61 "H511_IN15_Sample_L_1765511299.L" Detector: H511_IN15_Detector_I=0 H511_IN15_Detector_ERR=0 H511_IN15_Detector_N=0 "H511_IN15_Detector_1765511299.x_y" Detector: H511_IN15_Spectrometer_I=828989 H511_IN15_Spectrometer_ERR=369604 H511_IN15_Spectrometer_N=30 "H511_IN15_Spectrometer_1765511299.A_E" Detector: H511_IN15_Diffractometer_I=318147 H511_IN15_Diffractometer_ERR=202870 H511_IN15_Diffractometer_N=15 "H511_IN15_Diffractometer_1765511299.th_y" Detector: H512_VTE_I=9.3333e+10 H512_VTE_ERR=3.29842e+09 H512_VTE_N=13254 "H512_VTE_1765511299.x_y" Detector: D22_PreV_I=7.62329e+10 D22_PreV_ERR=3.16357e+09 D22_PreV_N=9140 "D22_PreV_1765511299.x_y" Detector: H51_D22_Sample_Div_I=9.74531e+08 H51_D22_Sample_Div_ERR=2.52925e+08 H51_D22_Sample_Div_N=68 "H51_D22_Sample_Div_1765511299.hd_vd" Detector: H51_D22_Sample_XY_I=9.74531e+08 H51_D22_Sample_XY_ERR=2.52925e+08 H51_D22_Sample_XY_N=68 "H51_D22_Sample_XY_1765511299.x_y" Detector: H51_D22_Sample_L_I=9.74531e+08 H51_D22_Sample_L_ERR=2.52925e+08 H51_D22_Sample_L_N=68 "H51_D22_Sample_L_1765511299.L" Detector: D22_Detector_I=4.44805e-83 D22_Detector_ERR=4.44805e-83 D22_Detector_N=1 "D22_Detector_1765511299.x_y" Finally [ILL_H5: 1]. Time: 2 [s] Finally [ILL_H5: 1]. Time: 2 [s] Isotropic_Sqw: H53_D16_Sample: Scattering fraction=0.98266 of incoming intensity Absorption fraction =0.0122245 Single scattering intensity =5.31373e+07 (coh=0 inc=5.31373e+07) Multiple scattering intensity =0 Isotropic_Sqw: H51_D22_Sample: Scattering fraction=0.913711 of incoming intensity Absorption fraction =0.00986615 Single scattering intensity =8.84051e+07 (coh=0 inc=8.84051e+07) Multiple scattering intensity =0 INFO: Placing instr file copy ILL_H5.instr in dataset 1 INFO: Placing generated c-code copy ILL_H5.c in dataset 1