INFO: Using directory: "1" INFO: Using existing c-file: ./ILL_H5.c INFO: Using existing binary: ./ILL_H5.out INFO: === 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]. Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/HOPG.rfl' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/data/Rb_liq_coh.sqw' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/H2O_liq.qSq' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/SiO2_quartza.laz' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/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 '/u/data/pkwi/McStas/mcstas/3.x-dev/data/H2O_liq.qSq' (Table_Read_Offset) Opening input file '/u/data/pkwi/McStas/mcstas/3.x-dev/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=7.46541e+13 H5_ERR=5.47129e+10 H5_N=3.86535e+06 "H5_1731898760.x_y" Detector: H53_origin_I=1.84284e+13 H53_origin_ERR=2.72013e+10 H53_origin_N=943367 "H53_origin_1731898760.hd_vd" Detector: H52_origin_I=4.5891e+12 H52_origin_ERR=1.35759e+10 H52_origin_N=234966 "H52_origin_1731898760.hd_vd" Detector: H51_origin_I=1.22805e+13 H51_origin_ERR=2.22042e+10 H51_origin_N=629549 "H51_origin_1731898760.hd_vd" Detector: H53_Obt_Out_I=1.59351e+12 H53_Obt_Out_ERR=7.63084e+09 H53_Obt_Out_N=510493 "H53_Obt_Out_1731898760.x_y" Detector: H53_IN14_Monochromator_Cradle_I=7.73005e+11 H53_IN14_Monochromator_Cradle_ERR=4.75412e+09 H53_IN14_Monochromator_Cradle_N=409861 "H53_IN14_Monochromator_Cradle_1731898760.x_y" Detector: H53_IN14_Sample_Div_I=4.60419e+09 H53_IN14_Sample_Div_ERR=4.03027e+08 H53_IN14_Sample_Div_N=447 "H53_IN14_Sample_Div_1731898760.hd_vd" Detector: H53_IN14_Sample_XY_I=7.43349e+09 H53_IN14_Sample_XY_ERR=4.97781e+08 H53_IN14_Sample_XY_N=1124 "H53_IN14_Sample_XY_1731898760.x_y" Detector: H53_IN14_Sample_L_I=7.037e+09 H53_IN14_Sample_L_ERR=4.84919e+08 H53_IN14_Sample_L_N=1102 "H53_IN14_Sample_L_1731898760.L" Detector: H53_IN14_Spectrometer_I=4.13304e+06 H53_IN14_Spectrometer_ERR=4.62054e+06 H53_IN14_Spectrometer_N=4 "H53_IN14_Spectrometer_1731898763.A_E" Detector: H53_IN14_Diffractometer_I=4.27102e-06 H53_IN14_Diffractometer_ERR=3.9689e-06 H53_IN14_Diffractometer_N=2 "H53_IN14_Diffractometer_1731898763.th_y" Detector: He3H_I=0 He3H_ERR=0 He3H_N=0 "He3H.dat" Detector: H53_VTE_I=5.16894e+11 H53_VTE_ERR=3.41206e+09 H53_VTE_N=313660 "H53_VTE_1731898763.x_y" Detector: H53_IN16_Monochromator_Cradle_I=4.19226e+11 H53_IN16_Monochromator_Cradle_ERR=3.0546e+09 H53_IN16_Monochromator_Cradle_N=248262 "H53_IN16_Monochromator_Cradle_1731898764.x_y" Detector: H53_IN16_Sample_Div_I=9.08161e+08 H53_IN16_Sample_Div_ERR=1.55345e+08 H53_IN16_Sample_Div_N=288 "H53_IN16_Sample_Div_1731898764.hd_vd" Detector: H53_IN16_Sample_XY_I=2.63543e+09 H53_IN16_Sample_XY_ERR=2.73132e+08 H53_IN16_Sample_XY_N=957 "H53_IN16_Sample_XY_1731898764.x_y" Detector: H53_IN16_Sample_L_I=2.63543e+09 H53_IN16_Sample_L_ERR=2.73133e+08 H53_IN16_Sample_L_N=955 "H53_IN16_Sample_L_1731898764.L" Detector: H53_IN16_Spectrometer_I=62617.1 H53_IN16_Spectrometer_ERR=76690 H53_IN16_Spectrometer_N=2 "H53_IN16_Spectrometer_1731898767.A_E" Detector: H53_IN16_Diffractometer_I=62617.1 H53_IN16_Diffractometer_ERR=76690 H53_IN16_Diffractometer_N=2 "H53_IN16_Diffractometer_1731898767.th_y" Detector: H53_D16_Monochromator_Cradle_I=3.81495e+11 H53_D16_Monochromator_Cradle_ERR=3.07292e+09 H53_D16_Monochromator_Cradle_N=188249 "H53_D16_Monochromator_Cradle_1731898767.x_y" Detector: H53_D16_Sample_Div_I=9.61541e+08 H53_D16_Sample_Div_ERR=1.77393e+08 H53_D16_Sample_Div_N=148 "H53_D16_Sample_Div_1731898767.hd_vd" Detector: H53_D16_Sample_XY_I=2.34801e+09 H53_D16_Sample_XY_ERR=2.64045e+08 H53_D16_Sample_XY_N=461 "H53_D16_Sample_XY_1731898767.x_y" Detector: H53_D16_Sample_L_I=2.34801e+09 H53_D16_Sample_L_ERR=2.64046e+08 H53_D16_Sample_L_N=459 "H53_D16_Sample_L_1731898767.L" Detector: H53_D16_Detector_I=1.32326e-52 H53_D16_Detector_ERR=1.62066e-52 H53_D16_Detector_N=2 "H53_D16_Detector_1731898767.x_y" Detector: H53_D16_Spectrometer_I=4.40558e+07 H53_D16_Spectrometer_ERR=2.47315e+07 H53_D16_Spectrometer_N=26 "H53_D16_Spectrometer_1731898767.A_E" Detector: H53_D16_Diffractometer_I=2.09865e+07 H53_D16_Diffractometer_ERR=1.80612e+07 H53_D16_Diffractometer_N=20 "H53_D16_Diffractometer_1731898767.th_y" Detector: H53_SADAM_Monochromator_Cradle_I=3.48669e+11 H53_SADAM_Monochromator_Cradle_ERR=3.10466e+09 H53_SADAM_Monochromator_Cradle_N=144629 "H53_SADAM_Monochromator_Cradle_1731898767.x_y" Detector: H53_SADAM_Sample_Div_I=6.07994e+08 H53_SADAM_Sample_Div_ERR=1.333e+08 H53_SADAM_Sample_Div_N=88 "H53_SADAM_Sample_Div_1731898767.hd_vd" Detector: H53_SADAM_Sample_XY_I=1.6042e+09 H53_SADAM_Sample_XY_ERR=2.12124e+08 H53_SADAM_Sample_XY_N=260 "H53_SADAM_Sample_XY_1731898767.x_y" Detector: H53_SADAM_Sample_L_I=1.6042e+09 H53_SADAM_Sample_L_ERR=2.12124e+08 H53_SADAM_Sample_L_N=260 "H53_SADAM_Sample_L_1731898767.L" Detector: H53_SADAM_Detector_I=0 H53_SADAM_Detector_ERR=0 H53_SADAM_Detector_N=0 "H53_SADAM_Detector_1731898769.x_y" Detector: H53_SADAM_Spectrometer_I=1.56309e-60 H53_SADAM_Spectrometer_ERR=1.56309e-60 H53_SADAM_Spectrometer_N=1 "H53_SADAM_Spectrometer_1731898769.A_E" Detector: H53_SADAM_Diffractometer_I=1.56309e-60 H53_SADAM_Diffractometer_ERR=1.56309e-60 H53_SADAM_Diffractometer_N=1 "H53_SADAM_Diffractometer_1731898769.th_y" Detector: H53_CryoEDM_In_L_I=3.13228e+11 H53_CryoEDM_In_L_ERR=3.10565e+09 H53_CryoEDM_In_L_N=102306 "H53_CryoEDM_In_L_1731898769.L" Detector: H53_CryoEDM_mirror_ReflectXY_I=7.90917e+09 H53_CryoEDM_mirror_ReflectXY_ERR=1.56888e+08 H53_CryoEDM_mirror_ReflectXY_N=10431 "H53_CryoEDM_mirror_ReflectXY.dat" Detector: H53_CryoEDM_mirror_TransmitXY_I=7.49548e+10 H53_CryoEDM_mirror_TransmitXY_ERR=7.32203e+09 H53_CryoEDM_mirror_TransmitXY_N=548 "H53_CryoEDM_mirror_TransmitXY.dat" Detector: H53_CryoEDM_Sample_L_I=1.27485e+10 H53_CryoEDM_Sample_L_ERR=1.96191e+08 H53_CryoEDM_Sample_L_N=25563 "H53_CryoEDM_Sample_L_1731898769.L" Detector: H53_CryoEDM_Sample_Div_I=1.26966e+10 H53_CryoEDM_Sample_Div_ERR=1.95961e+08 H53_CryoEDM_Sample_Div_N=19857 "H53_CryoEDM_Sample_Div_1731898769.hd_vd" Detector: H53_CryoEDM_Sample_XY_I=1.27485e+10 H53_CryoEDM_Sample_XY_ERR=1.96191e+08 H53_CryoEDM_Sample_XY_N=25593 "H53_CryoEDM_Sample_XY_1731898769.x_y" Detector: H52_Obt_Out_I=1.51469e+11 H52_Obt_Out_ERR=2.11539e+09 H52_Obt_Out_N=64921 "H52_Obt_Out_1731898769.x_y" Detector: H51_Obt_Out_I=4.7599e+11 H51_Obt_Out_ERR=3.8404e+09 H51_Obt_Out_N=189765 "H51_Obt_Out_1731898769.x_y" Detector: H51_S2_Out_I=3.49777e+11 H51_S2_Out_ERR=3.32583e+09 H51_S2_Out_N=157701 "H51_S2_Out_1731898769.x_y" Detector: H51_split_2_I=1.62278e+11 H51_split_2_ERR=2.26878e+09 H51_split_2_N=72503 "H51_split_2_1731898769.x_y" Detector: H51_split_1_I=1.60788e+11 H51_split_1_ERR=2.25682e+09 H51_split_1_N=72109 "H51_split_1_1731898769.x_y" Detector: H511_mirror_ReflectXY_I=1.51911e+10 H511_mirror_ReflectXY_ERR=2.21937e+08 H511_mirror_ReflectXY_N=20667 "H511_mirror_ReflectXY.dat" Detector: H511_mirror_TransmitXY_I=1.03504e+11 H511_mirror_TransmitXY_ERR=8.7388e+09 H511_mirror_TransmitXY_N=1078 "H511_mirror_TransmitXY.dat" Detector: H511_mirror_outdXY_I=1.51911e+10 H511_mirror_outdXY_ERR=2.21937e+08 H511_mirror_outdXY_N=20563 "H511_mirror_outdXY_1731898769.hd_vd" Detector: H511_VTE_I=1.20674e+10 H511_VTE_ERR=2.06734e+08 H511_VTE_N=21575 "H511_VTE_1731898769.x_y" Detector: H511_IN15_Sample_Div_I=2.44923e+08 H511_IN15_Sample_Div_ERR=2.22721e+07 H511_IN15_Sample_Div_N=356 "H511_IN15_Sample_Div_1731898769.hd_vd" Detector: H511_IN15_Sample_XY_I=2.44923e+08 H511_IN15_Sample_XY_ERR=2.22721e+07 H511_IN15_Sample_XY_N=356 "H511_IN15_Sample_XY_1731898769.x_y" Detector: H511_IN15_Sample_L_I=2.44923e+08 H511_IN15_Sample_L_ERR=2.22721e+07 H511_IN15_Sample_L_N=356 "H511_IN15_Sample_L_1731898769.L" Detector: H511_IN15_Detector_I=0 H511_IN15_Detector_ERR=0 H511_IN15_Detector_N=0 "H511_IN15_Detector_1731898769.x_y" Detector: H511_IN15_Spectrometer_I=1.08097e+06 H511_IN15_Spectrometer_ERR=170968 H511_IN15_Spectrometer_N=178 "H511_IN15_Spectrometer_1731898769.A_E" Detector: H511_IN15_Diffractometer_I=707749 H511_IN15_Diffractometer_ERR=141963 H511_IN15_Diffractometer_N=103 "H511_IN15_Diffractometer_1731898769.th_y" Detector: H512_VTE_I=9.04129e+10 H512_VTE_ERR=1.4609e+09 H512_VTE_N=67165 "H512_VTE_1731898769.x_y" Detector: D22_PreV_I=7.26407e+10 D22_PreV_ERR=1.37331e+09 D22_PreV_N=46677 "D22_PreV_1731898769.x_y" Detector: H51_D22_Sample_Div_I=1.18635e+09 H51_D22_Sample_Div_ERR=1.265e+08 H51_D22_Sample_Div_N=337 "H51_D22_Sample_Div_1731898769.hd_vd" Detector: H51_D22_Sample_XY_I=1.18635e+09 H51_D22_Sample_XY_ERR=1.265e+08 H51_D22_Sample_XY_N=337 "H51_D22_Sample_XY_1731898769.x_y" Detector: H51_D22_Sample_L_I=1.18635e+09 H51_D22_Sample_L_ERR=1.265e+08 H51_D22_Sample_L_N=337 "H51_D22_Sample_L_1731898769.L" Detector: D22_Detector_I=9.00734e+06 D22_Detector_ERR=5.40693e+06 D22_Detector_N=11 "D22_Detector_1731898769.x_y" Finally [ILL_H5: 1]. Time: 14 [s] Isotropic_Sqw: H53_IN14_Sample: 4 neutron events (out of 8) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H53_IN14_Sample: Scattering fraction=0.0592891 of incoming intensity Absorption fraction =0.125017 Single scattering intensity =4.13304e+06 (coh=4.13304e+06 inc=0) Multiple scattering intensity =0 Isotropic_Sqw: H53_IN16_Sample: 10 neutron events (out of 12) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H53_IN16_Sample: Scattering fraction=0.0325132 of incoming intensity Absorption fraction =0.177368 Single scattering intensity =62617.1 (coh=62617.1 inc=0) Multiple scattering intensity =0 Isotropic_Sqw: H53_D16_Sample: Scattering fraction=0.972144 of incoming intensity Absorption fraction =0.00846761 Single scattering intensity =5.43284e+07 (coh=4.10207e-14 inc=5.43284e+07) Multiple scattering intensity =0 Isotropic_Sqw: H53_SADAM_Sample: Scattering fraction=0.129769 of incoming intensity Absorption fraction =0.038085 Single scattering intensity =1.56309e-60 (coh=1.56309e-60 inc=0) Multiple scattering intensity =0 Isotropic_Sqw: H51_D22_Sample: 1 neutron events (out of 194) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H51_D22_Sample: Scattering fraction=0.97938 of incoming intensity Absorption fraction =0.00978316 Single scattering intensity =1.20254e+08 (coh=4.36007e+06 inc=1.15894e+08) 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