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=7.46622e+13 H5_ERR=3.86907e+10 H5_N=7.73277e+06 "H5_1734866719.x_y" Detector: H53_origin_I=1.84202e+13 H53_origin_ERR=1.92289e+10 H53_origin_N=1.88615e+06 "H53_origin_1734866719.hd_vd" Detector: H52_origin_I=4.59877e+12 H52_origin_ERR=9.61231e+09 H52_origin_N=470557 "H52_origin_1734866719.hd_vd" Detector: H51_origin_I=1.22683e+13 H51_origin_ERR=1.56889e+10 H51_origin_N=1.25868e+06 "H51_origin_1734866719.hd_vd" Detector: H53_Obt_Out_I=1.59555e+12 H53_Obt_Out_ERR=5.40233e+09 H53_Obt_Out_N=1.01989e+06 "H53_Obt_Out_1734866719.x_y" Detector: H53_IN14_Monochromator_Cradle_I=7.79311e+11 H53_IN14_Monochromator_Cradle_ERR=3.38838e+09 H53_IN14_Monochromator_Cradle_N=819003 "H53_IN14_Monochromator_Cradle_1734866719.x_y" Detector: H53_IN14_Sample_Div_I=4.89214e+09 H53_IN14_Sample_Div_ERR=3.08143e+08 H53_IN14_Sample_Div_N=879 "H53_IN14_Sample_Div_1734866719.hd_vd" Detector: H53_IN14_Sample_XY_I=8.20146e+09 H53_IN14_Sample_XY_ERR=3.91573e+08 H53_IN14_Sample_XY_N=2227 "H53_IN14_Sample_XY_1734866719.x_y" Detector: H53_IN14_Sample_L_I=7.91899e+09 H53_IN14_Sample_L_ERR=3.86029e+08 H53_IN14_Sample_L_N=2190 "H53_IN14_Sample_L_1734866719.L" Detector: H53_IN14_Spectrometer_I=2.23461e+06 H53_IN14_Spectrometer_ERR=2.23413e+06 H53_IN14_Spectrometer_N=6 "H53_IN14_Spectrometer_1734866722.A_E" Detector: H53_IN14_Diffractometer_I=168088 H53_IN14_Diffractometer_ERR=187929 H53_IN14_Diffractometer_N=4 "H53_IN14_Diffractometer_1734866722.th_y" Detector: He3H_I=0 He3H_ERR=0 He3H_N=0 "He3H.dat" Detector: H53_VTE_I=5.18492e+11 H53_VTE_ERR=2.41311e+09 H53_VTE_N=626529 "H53_VTE_1734866722.x_y" Detector: H53_IN16_Monochromator_Cradle_I=4.19259e+11 H53_IN16_Monochromator_Cradle_ERR=2.15684e+09 H53_IN16_Monochromator_Cradle_N=495924 "H53_IN16_Monochromator_Cradle_1734866722.x_y" Detector: H53_IN16_Sample_Div_I=9.30798e+08 H53_IN16_Sample_Div_ERR=1.08304e+08 H53_IN16_Sample_Div_N=590 "H53_IN16_Sample_Div_1734866722.hd_vd" Detector: H53_IN16_Sample_XY_I=2.51054e+09 H53_IN16_Sample_XY_ERR=1.84174e+08 H53_IN16_Sample_XY_N=1876 "H53_IN16_Sample_XY_1734866722.x_y" Detector: H53_IN16_Sample_L_I=2.51054e+09 H53_IN16_Sample_L_ERR=1.84174e+08 H53_IN16_Sample_L_N=1874 "H53_IN16_Sample_L_1734866722.L" Detector: H53_IN16_Spectrometer_I=1.09372e+06 H53_IN16_Spectrometer_ERR=792016 H53_IN16_Spectrometer_N=8 "H53_IN16_Spectrometer_1734866725.A_E" Detector: H53_IN16_Diffractometer_I=528914 H53_IN16_Diffractometer_ERR=537544 H53_IN16_Diffractometer_N=6 "H53_IN16_Diffractometer_1734866725.th_y" Detector: H53_D16_Monochromator_Cradle_I=3.82276e+11 H53_D16_Monochromator_Cradle_ERR=2.17468e+09 H53_D16_Monochromator_Cradle_N=376525 "H53_D16_Monochromator_Cradle_1734866725.x_y" Detector: H53_D16_Sample_Div_I=8.30805e+08 H53_D16_Sample_Div_ERR=1.13041e+08 H53_D16_Sample_Div_N=276 "H53_D16_Sample_Div_1734866725.hd_vd" Detector: H53_D16_Sample_XY_I=2.17283e+09 H53_D16_Sample_XY_ERR=1.75491e+08 H53_D16_Sample_XY_N=903 "H53_D16_Sample_XY_1734866725.x_y" Detector: H53_D16_Sample_L_I=2.17283e+09 H53_D16_Sample_L_ERR=1.75491e+08 H53_D16_Sample_L_N=896 "H53_D16_Sample_L_1734866725.L" Detector: H53_D16_Detector_I=6.6163e-53 H53_D16_Detector_ERR=8.10328e-53 H53_D16_Detector_N=2 "H53_D16_Detector_1734866725.x_y" Detector: H53_D16_Spectrometer_I=3.16765e+07 H53_D16_Spectrometer_ERR=1.29237e+07 H53_D16_Spectrometer_N=40 "H53_D16_Spectrometer_1734866725.A_E" Detector: H53_D16_Diffractometer_I=1.69294e+07 H53_D16_Diffractometer_ERR=9.56914e+06 H53_D16_Diffractometer_N=25 "H53_D16_Diffractometer_1734866725.th_y" Detector: H53_SADAM_Monochromator_Cradle_I=3.49625e+11 H53_SADAM_Monochromator_Cradle_ERR=2.19502e+09 H53_SADAM_Monochromator_Cradle_N=289614 "H53_SADAM_Monochromator_Cradle_1734866725.x_y" Detector: H53_SADAM_Sample_Div_I=6.22117e+08 H53_SADAM_Sample_Div_ERR=9.66998e+07 H53_SADAM_Sample_Div_N=154 "H53_SADAM_Sample_Div_1734866725.hd_vd" Detector: H53_SADAM_Sample_XY_I=1.92091e+09 H53_SADAM_Sample_XY_ERR=1.73129e+08 H53_SADAM_Sample_XY_N=536 "H53_SADAM_Sample_XY_1734866725.x_y" Detector: H53_SADAM_Sample_L_I=1.92091e+09 H53_SADAM_Sample_L_ERR=1.73129e+08 H53_SADAM_Sample_L_N=532 "H53_SADAM_Sample_L_1734866725.L" Detector: H53_SADAM_Detector_I=0 H53_SADAM_Detector_ERR=0 H53_SADAM_Detector_N=0 "H53_SADAM_Detector_1734866727.x_y" Detector: H53_SADAM_Spectrometer_I=7.81543e-61 H53_SADAM_Spectrometer_ERR=7.81543e-61 H53_SADAM_Spectrometer_N=1 "H53_SADAM_Spectrometer_1734866727.A_E" Detector: H53_SADAM_Diffractometer_I=7.81543e-61 H53_SADAM_Diffractometer_ERR=7.81543e-61 H53_SADAM_Diffractometer_N=1 "H53_SADAM_Diffractometer_1734866727.th_y" Detector: H53_CryoEDM_In_L_I=3.14405e+11 H53_CryoEDM_In_L_ERR=2.19958e+09 H53_CryoEDM_In_L_N=204851 "H53_CryoEDM_In_L_1734866727.L" Detector: H53_CryoEDM_mirror_ReflectXY_I=8.03702e+09 H53_CryoEDM_mirror_ReflectXY_ERR=1.11704e+08 H53_CryoEDM_mirror_ReflectXY_N=21069 "H53_CryoEDM_mirror_ReflectXY.dat" Detector: H53_CryoEDM_mirror_TransmitXY_I=6.99542e+10 H53_CryoEDM_mirror_TransmitXY_ERR=4.86334e+09 H53_CryoEDM_mirror_TransmitXY_N=1093 "H53_CryoEDM_mirror_TransmitXY.dat" Detector: H53_CryoEDM_Sample_L_I=1.27738e+10 H53_CryoEDM_Sample_L_ERR=1.38473e+08 H53_CryoEDM_Sample_L_N=51283 "H53_CryoEDM_Sample_L_1734866727.L" Detector: H53_CryoEDM_Sample_Div_I=1.27142e+10 H53_CryoEDM_Sample_Div_ERR=1.38281e+08 H53_CryoEDM_Sample_Div_N=39935 "H53_CryoEDM_Sample_Div_1734866727.hd_vd" Detector: H53_CryoEDM_Sample_XY_I=1.27738e+10 H53_CryoEDM_Sample_XY_ERR=1.38473e+08 H53_CryoEDM_Sample_XY_N=51349 "H53_CryoEDM_Sample_XY_1734866727.x_y" Detector: H52_Obt_Out_I=1.50915e+11 H52_Obt_Out_ERR=1.49445e+09 H52_Obt_Out_N=130035 "H52_Obt_Out_1734866727.x_y" Detector: H51_Obt_Out_I=4.74596e+11 H51_Obt_Out_ERR=2.70575e+09 H51_Obt_Out_N=380043 "H51_Obt_Out_1734866727.x_y" Detector: H51_S2_Out_I=3.47355e+11 H51_S2_Out_ERR=2.33656e+09 H51_S2_Out_N=316032 "H51_S2_Out_1734866727.x_y" Detector: H51_split_2_I=1.60698e+11 H51_split_2_ERR=1.58872e+09 H51_split_2_N=145013 "H51_split_2_1734866727.x_y" Detector: H51_split_1_I=1.59471e+11 H51_split_1_ERR=1.58392e+09 H51_split_1_N=144843 "H51_split_1_1734866727.x_y" Detector: H511_mirror_ReflectXY_I=1.52839e+10 H511_mirror_ReflectXY_ERR=1.57287e+08 H511_mirror_ReflectXY_N=41611 "H511_mirror_ReflectXY.dat" Detector: H511_mirror_TransmitXY_I=1.01589e+11 H511_mirror_TransmitXY_ERR=5.98469e+09 H511_mirror_TransmitXY_N=2231 "H511_mirror_TransmitXY.dat" Detector: H511_mirror_outdXY_I=1.52839e+10 H511_mirror_outdXY_ERR=1.57287e+08 H511_mirror_outdXY_N=41419 "H511_mirror_outdXY_1734866727.hd_vd" Detector: H511_VTE_I=1.21153e+10 H511_VTE_ERR=1.46182e+08 H511_VTE_N=43355 "H511_VTE_1734866727.x_y" Detector: H511_IN15_Sample_Div_I=9.5466e+08 H511_IN15_Sample_Div_ERR=3.08761e+07 H511_IN15_Sample_Div_N=2676 "H511_IN15_Sample_Div_1734866727.hd_vd" Detector: H511_IN15_Sample_XY_I=9.5466e+08 H511_IN15_Sample_XY_ERR=3.08761e+07 H511_IN15_Sample_XY_N=2676 "H511_IN15_Sample_XY_1734866727.x_y" Detector: H511_IN15_Sample_L_I=9.5466e+08 H511_IN15_Sample_L_ERR=3.08761e+07 H511_IN15_Sample_L_N=2676 "H511_IN15_Sample_L_1734866727.L" Detector: H511_IN15_Detector_I=13555 H511_IN15_Detector_ERR=14981.5 H511_IN15_Detector_N=3 "H511_IN15_Detector_1734866727.x_y" Detector: H511_IN15_Spectrometer_I=4.34695e+06 H511_IN15_Spectrometer_ERR=249527 H511_IN15_Spectrometer_N=1336 "H511_IN15_Spectrometer_1734866727.A_E" Detector: H511_IN15_Diffractometer_I=2.69586e+06 H511_IN15_Diffractometer_ERR=199000 H511_IN15_Diffractometer_N=792 "H511_IN15_Diffractometer_1734866727.th_y" Detector: H512_VTE_I=8.836e+10 H512_VTE_ERR=1.0064e+09 H512_VTE_N=134385 "H512_VTE_1734866727.x_y" Detector: D22_PreV_I=7.12937e+10 D22_PreV_ERR=9.54957e+08 D22_PreV_N=93440 "D22_PreV_1734866727.x_y" Detector: H51_D22_Sample_Div_I=1.11243e+09 H51_D22_Sample_Div_ERR=8.49794e+07 H51_D22_Sample_Div_N=672 "H51_D22_Sample_Div_1734866727.hd_vd" Detector: H51_D22_Sample_XY_I=1.11243e+09 H51_D22_Sample_XY_ERR=8.49794e+07 H51_D22_Sample_XY_N=672 "H51_D22_Sample_XY_1734866727.x_y" Detector: H51_D22_Sample_L_I=1.11243e+09 H51_D22_Sample_L_ERR=8.49794e+07 H51_D22_Sample_L_N=672 "H51_D22_Sample_L_1734866727.L" Detector: D22_Detector_I=9.33705e+06 D22_Detector_ERR=3.70046e+06 D22_Detector_N=21 "D22_Detector_1734866727.x_y" Finally [ILL_H5: 1]. Time: 18 [s] Isotropic_Sqw: H53_IN14_Sample: 5 neutron events (out of 11) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H53_IN14_Sample: Scattering fraction=0.0594318 of incoming intensity Absorption fraction =0.125047 Single scattering intensity =2.23461e+06 (coh=2.06652e+06 inc=168088) Multiple scattering intensity =0 Isotropic_Sqw: H53_IN16_Sample: 137 neutron events (out of 145) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H53_IN16_Sample: Scattering fraction=0.0555621 of incoming intensity Absorption fraction =0.17649 Single scattering intensity =1.09372e+06 (coh=1.09372e+06 inc=0) Multiple scattering intensity =0 Isotropic_Sqw: H53_D16_Sample: Scattering fraction=0.975319 of incoming intensity Absorption fraction =0.0094582 Single scattering intensity =3.68249e+07 (coh=103.472 inc=3.68248e+07) Multiple scattering intensity =0 Isotropic_Sqw: H53_SADAM_Sample: Scattering fraction=0.129769 of incoming intensity Absorption fraction =0.038085 Single scattering intensity =7.81543e-61 (coh=7.81543e-61 inc=0) Multiple scattering intensity =0 Isotropic_Sqw: H51_D22_Sample: 1 neutron events (out of 375) that should have scattered were transmitted because scattering conditions WARNING could not be satisfied after 100 tries. Isotropic_Sqw: H51_D22_Sample: Scattering fraction=0.977558 of incoming intensity Absorption fraction =0.00980727 Single scattering intensity =1.1604e+08 (coh=5.43503e+06 inc=1.10605e+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