loading system configuration
loading user configuration from /users/willend/.mcstas/3.x-dev/mccode_config.json
loading override configuration from /users/willend/McCode/tools/Python/mctest/../mccodelib/mcstas-test/McStas_DUAL_A100_DMSC/mccode_config.json
INFO: Using directory: "1"
INFO: Using existing c-file: ./ILL_H10_IN8.c
INFO: Using existing binary: ./ILL_H10_IN8.out
INFO: ===
--------------------------------------------------------------------------
WARNING: No preset parameters were found for the device that Open MPI
detected:

  Local host:            r6n22
  Device name:           mlx5_0
  Device vendor ID:      0x02c9
  Device vendor part ID: 4123

Default device parameters will be used, which may result in lower
performance.  You can edit any of the files specified by the
btl_openib_device_param_files MCA parameter to set values for your
device.

NOTE: You can turn off this warning by setting the MCA parameter
      btl_openib_warn_no_device_params_found to 0.
--------------------------------------------------------------------------
Simulation 'ILL_H10_IN8' (/users/willend/TESTS/2022-11-01/McStas_DUAL_A100_DMSC_5e7/ILL_H10_IN8/ILL_H10_IN8.instr): running on 2 nodes (master is 'r6n22.esss.dk', MPI version 3.1).
Have found 2 GPU devices on rank 0. Will use device 0.
Have found 2 GPU devices on rank 1. Will use device 1.
templateTAS: Detailed TAS configuration
* Incoming beam: EI=51.8 [meV] KI=5 [Angs-1] Vi=3148.11 [m/s]
* Outgoing beam: EF=51.8 [meV] KF=5 [Angs-1] Vf=3148.11 [m/s]
* Transfer:     EN=0 [meV] QM=1 [Angs-1]
Angles: A1=20.35 A2=40.7 A3=0 A4=-11.48 A5=17.52 A6=35.04 [deg]
Monochromator: DM=1.807 [Angs] RMH=6.314 [m] RMV=0.7634 [m] curved
Analyzer:      DA=2.087 [Angs] RAH=3.171 [m] RAV=0.2874 [m] curved
Sample:        Powder V.lau
[ILL_H10_IN8] Initialize
templateTAS: Detailed TAS configuration
* Incoming beam: EI=51.8 [meV] KI=5 [Angs-1] Vi=3148.11 [m/s]
* Outgoing beam: EF=51.8 [meV] KF=5 [Angs-1] Vf=3148.11 [m/s]
* Transfer:     EN=0 [meV] QM=1 [Angs-1]
Angles: A1=20.35 A2=40.7 A3=0 A4=-11.48 A5=17.52 A6=35.04 [deg]
Monochromator: DM=1.807 [Angs] RMH=6.314 [m] RMV=0.7634 [m] curved
Analyzer:      DA=2.087 [Angs] RAH=3.171 [m] RAV=0.2874 [m] curved
Sample:        Powder V.lau
[ILL_H10_IN8] Initialize
Isotropic_Sqw: Sample: is a hollow cylinder: radius=0.010000 thickness=0.005000 height=0.050000 [J Comp Phys 228 (2009) 5251]
Isotropic_sqw: Sample: Powder file probably of type Crystallographica/Fullprof (lau)
WARNING:       but F2 unit is set to powder_barns=1 (barns). Intensity might be 100 times too high.
Isotropic_sqw: Converting 3558 powder lines from V.lau into S(q,w) data
Isotropic_sqw: q range [0:25.0197], creating 423 elements vector
Isotropic_Sqw: Sample: Generated V.lau coherent Sqw
                   q=[0:24.9605 Angs-1] w=[0:0 meV] |S|=0.869429 size=[423x1] sigma=0.01834 [barns]
               Mainly elastic scattering.
Isotropic_Sqw: Sample: Using Isotropic elastic incoherent scattering (sigma=5.07999 [barns])
Isotropic_Sqw: Sample: Sample temperature not defined (T=0).
Warning        Disabling detailed balance.
[r6n22.esss.dk:4137311] 1 more process has sent help message help-mpi-btl-openib.txt / no device params found
[r6n22.esss.dk:4137311] Set MCA parameter "orte_base_help_aggregate" to 0 to see all help / error messages
*** TRACE end *** 

Save [ILL_H10_IN8]
Detector: D4_SC2_1D_I=1.02399e+10 D4_SC2_1D_ERR=2.94757e+06 D4_SC2_1D_N=1.83083e+07 "D4_SC2_1D_1667264397.L"
Detector: Sample_Cradle_I=9.86185e+07 Sample_Cradle_ERR=73718.1 Sample_Cradle_N=3.85033e+06 "Sample_Cradle"
Detector: D7_SC3_1D_I=9.33375e+08 D7_SC3_1D_ERR=424803 D7_SC3_1D_N=6.2594e+07 "D7_SC3_1D_1667264397.th_E"

Finally [ILL_H10_IN8: 1]. Time: 4 [s] 
Detector: He3H_I=517.691 He3H_ERR=2.82143 He3H_N=142195 "He3H.psd"

Finally [ILL_H10_IN8: 1]. Time: 4 [s] 
Isotropic_Sqw: Sample: Scattering fraction=0.370518 of incoming intensity
               Absorption fraction           =0.399575
               Single   scattering intensity =58171.9 (coh=5810.82 inc=52361.1)
               Multiple scattering intensity =0
INFO: Placing instr file copy /users/willend/TESTS/2022-11-01/McStas_DUAL_A100_DMSC_5e7/ILL_H10_IN8/ILL_H10_IN8.instr in dataset 1