'  '  '          '  '/'

INSTRUMENT          {

NIMROD          Instrument name
/home/aks45/Gudrun/GudrunN/run/NIMROD/MCM41GasAbsorption/          Gudrun input file directory:
/home/aks45/Gudrun/GudrunN/RawData/NIMROD/RB1800005/          Data file directory
nxs          Data file type
StartupFiles/NIMROD/NIMROD84modules+9monitors+LAB5Oct2012Detector.calib          Detector calibration file name
4          User table column number for phi values
StartupFiles/NIMROD/NIMROD84modules+9monitors+LAB5Oct2012Groups.dat          Groups file name
StartupFiles/NIMROD/NIMRODdeadtimeNone.cor          Deadtime constants file name
4 5          Spectrum number(s) for incident beam monitor
0  0          Wavelength range [Å] for monitor normalisation
8 9          Spectrum number(s) for transmission monitor
0.0001          Incident monitor quiet count constant
0.0001          Transmission monitor quiet count constant
0  0          Channel numbers for spike analysis
5          Spike analysis acceptance factor
0.05  12  0.1          Wavelength range to use [Å] and step size
200            No. of smooths on monitor
0.02  50.0  -0.05          Min, Max and step in x-scale (-ve for logarithmic binning)
0  0  0  0          0 0 0 0 to end input of specified values
1          Groups acceptance factor 
4          Merge power
0          Subtract single atom scattering?
2          By channel?
20.0          Incident flight path [m]
0          Spectrum number to output diagnostic files
StartupFiles/NIMROD/sears91_gudrun.dat          Neutron scattering parameters file
1          Scale selection: 1 = Q, 2 = d-space, 3 = wavelength, 4 = energy, 5 = TOF
0          Subtract wavelength-binned data?
/home/aks45/Gudrun/Gudrun2014/Gudrun          Folder where Gudrun started
/home/aks45/Gudrun/Gudrun2014/Gudrun/StartupFiles/SLS          Folder containing the startup file
0.03          Logarithmic step size
1          Hard group edges?
StartupFiles/NIMROD/NIMROD84modules+9monitors+LAB.nexus_txt          NeXus definition file
3          Number of iterations
0          Tweak the tweak factor(s)?

}

BEAM          {

FLATPLATE          Sample geometry
2          Number of beam profile values
1.0  1.0            Beam profile values (Maximum of 50 allowed currently)
0.05  0.2  100          Step size for absorption and m.s. calculation and no. of slices
10          Angular step for corrections [deg.]          
-1.5  1.5  -1.5  1.5          Incident beam edges relative to centre of sample [cm]
-2.0  2.0  -2.1  2.1          Scattered beam edges relative to centre of sample [cm]
StartupFiles/NIMROD/spectrum000.dat          Filename containing incident beam spectrum parameters
1.0          Overall background factor 
0.0          Sample dependent background factor
0.0          Shielding attenuation coefficient [per m per A] 

}

NORMALISATION          {

1  1          Number of  files and period number
NIMROD00053768.nxs          NORMALISATION data files
1  1          Number of  files and period number
NIMROD00053769.nxs          NORMALISATION BACKGROUND data files
1          Force calculation of corrections?
V  0  0.9485          Normalisation atomic composition
Nb  0  0.0515          Normalisation atomic composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.15  0.15          Upstream and downstream thicknesses [cm]
0.0  5          Angle of rotation and sample width (cm)
-0.072          Density atoms/Å^3?
200          Temperature for normalisation Placzek correction
TABLES          Total cross section source
*          Normalisation differential cross section filename
0.01          Lower limit on smoothed normalisation  
1.05          Normalisation degree of smoothing
0.0          Minimum normalisation signal to background ratio

}

SAMPLE BACKGROUND          {

1  1          Number of  files and period number
NIMROD00053326.nxs          SAMPLE BACKGROUND data files

}

SAMPLE Empty TiZr Container          {

1  1          Number of  files and period number
NIMROD00053329.nxs          SAMPLE Empty TiZr Container data files
1          Force calculation of sample corrections?
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.107  0.107          Upstream and downstream thicknesses [cm]
0  5          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
0          Temperature for Placzek correction:
TRANSMISSION          Total cross section source
1.0          Tweak factor
0.0          Top hat width (1/Å) for cleaning up Fourier Transform
0.0          Minimum radius for FT  [Å]
0.1          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
NIMROD00053329.msubw01          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.2          Power for broadening function e.g. 0.5
0.03          Step size [A] 
0          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          

SAMPLE  Dry MCM41 at 88K Adjust tweak factor 1 ver 2          {

4  1          Number of  files and period number
NIMROD00053339.nxs          SAMPLE  Dry MCM41 at 88K Adjust tweak factor 1 ver 2 data files
NIMROD00053340.nxs          SAMPLE  Dry MCM41 at 88K Adjust tweak factor 1 ver 2 data files
NIMROD00053341.nxs          SAMPLE  Dry MCM41 at 88K Adjust tweak factor 1 ver 2 data files
NIMROD00053342.nxs          SAMPLE  Dry MCM41 at 88K Adjust tweak factor 1 ver 2 data files
1          Force calculation of sample corrections?
Si  0  1.0          Composition
O  0  2.11          Composition
H  0  0.22          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.02484          Density atoms/Å^3?
0          Temperature for Placzek correction:
TRANSMISSION          Total cross section source
5.45          Tweak factor
-10.0          Top hat width (1/Å) for cleaning up Fourier Transform
0.7          Minimum radius for FT  [Å]
0.05          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
*          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.05          Power for broadening function e.g. 0.5
0.03          Step size [A] 
0          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

CONTAINER 2mm TiZr flat plate cell          {

1  1          Number of  files and period number
NIMROD00053329.nxs          CONTAINER 2mm TiZr flat plate cell data files
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
TRANSMISSION          Total cross section source
1.0          Tweak factor
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          

SAMPLE  D2 in MCM41 at 44-34K          {

24  1          Number of  files and period number
NIMROD00053554.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053555.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053556.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053557.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053558.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053559.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053560.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053561.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053562.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053563.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053564.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053565.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053566.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053567.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053568.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053569.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053570.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053571.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053572.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053573.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053574.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053575.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053576.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
NIMROD00053577.nxs          SAMPLE  D2 in MCM41 at 44-34K data files
1          Force calculation of sample corrections?
Si  0  1.0          Sample atomic composition
O  0  2.11          Sample atomic composition
H  0  0.22          Sample atomic composition
H  2  1.599          Sample atomic composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.03677          Density atoms/Å^3?
0          Temperature for sample Placzek correction
TRANSMISSION          Total cross section source
5.45          Sample tweak factor
-10          Top hat width (1/Å) for cleaning up Fourier Transform
0.6          Minimum radius for FT  [Å]
0.05          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
NIMROD00053554.msubw01          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.05          Power for broadening function e.g. 0.5
0.03          Step size [A] 
1          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

CONTAINER 2mm TiZr flat plate cell          {

1  1          Number of  files and period number
NIMROD00053329.nxs          CONTAINER 2mm TiZr flat plate cell data files
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
TRANSMISSION          Total cross section source
1.0          Tweak factor
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          

SAMPLE D2 in MCM41 at 28-27K          {

8  1          Number of  files and period number
NIMROD00053578.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053579.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053580.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053581.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053582.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053583.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053584.nxs          SAMPLE D2 in MCM41 at 28-27K data files
NIMROD00053585.nxs          SAMPLE D2 in MCM41 at 28-27K data files
1          Force calculation of sample corrections?
Si  0  1.0          Sample atomic composition
O  0  2.11          Sample atomic composition
H  0  0.22          Sample atomic composition
H  2  2.386          Sample atomic composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.04265          Density atoms/Å^3?
0          Temperature for sample Placzek correction
TRANSMISSION          Total cross section source
5.45          Sample tweak factor
-10          Top hat width (1/Å) for cleaning up Fourier Transform
0.6          Minimum radius for FT  [Å]
0.05          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
NIMROD00053578.msubw01          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.05          Power for broadening function e.g. 0.5
0.03          Step size [A] 
1          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

CONTAINER 2mm TiZr flat plate cell          {

1  1          Number of  files and period number
NIMROD00053329.nxs          CONTAINER 2mm TiZr flat plate cell data files
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
TRANSMISSION          Total cross section source
1.0          Tweak factor
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          

SAMPLE  D2 in MCM41 at 26K          {

3  1          Number of  files and period number
NIMROD00053586.nxs          SAMPLE  D2 in MCM41 at 26K data files
NIMROD00053587.nxs          SAMPLE  D2 in MCM41 at 26K data files
NIMROD00053588.nxs          SAMPLE  D2 in MCM41 at 26K data files
1          Force calculation of sample corrections?
Si  0  1.0          Sample atomic composition
O  0  2.11          Sample atomic composition
H  0  0.22          Sample atomic composition
H  2  2.678          Sample atomic composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.04482          Density atoms/Å^3?
0          Temperature for sample Placzek correction
TRANSMISSION          Total cross section source
5.45          Sample tweak factor
-10          Top hat width (1/Å) for cleaning up Fourier Transform
0.6          Minimum radius for FT  [Å]
0.05          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
NIMROD00053586.msubw01          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.05          Power for broadening function e.g. 0.5
0.03          Step size [A] 
1          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

CONTAINER 2mm TiZr flat plate cell          {

1  1          Number of  files and period number
NIMROD00053329.nxs          CONTAINER 2mm TiZr flat plate cell data files
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
TRANSMISSION          Total cross section source
1.0          Tweak factor
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          

SAMPLE  D2 in MCM41 at 25-24K          {

2  1          Number of  files and period number
NIMROD00053589.nxs          SAMPLE  D2 in MCM41 at 25-24K data files
NIMROD00053590.nxs          SAMPLE  D2 in MCM41 at 25-24K data files
1          Force calculation of sample corrections?
Si  0  1.0          Sample atomic composition
O  0  2.11          Sample atomic composition
H  0  0.22          Sample atomic composition
H  2  3.070          Sample atomic composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.04775          Density atoms/Å^3?
0          Temperature for sample Placzek correction
TRANSMISSION          Total cross section source
5.45          Sample tweak factor
-10          Top hat width (1/Å) for cleaning up Fourier Transform
0.6          Minimum radius for FT  [Å]
0.05          g(r) broadening at r = 1A [A]
0  0          0   0          to finish specifying wavelength range of resonance
0.0  1.0  0          Exponential amplitude and decay [1/A]
*  0  0          * 0 0 to specify end of exponential parameter input
1.0          Normalisation correction factor
NIMROD00053589.msubw01          Name of file containing self scattering as a function of wavelength [A]
0          Normalise to:Nothing
20.0          Maximum radius for FT [A]
0          Output units: b/atom/sr
0.05          Power for broadening function e.g. 0.5
0.03          Step size [A] 
1          Analyse this sample? 
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

CONTAINER 2mm TiZr flat plate cell          {

1  1          Number of  files and period number
NIMROD00053329.nxs          CONTAINER 2mm TiZr flat plate cell data files
Ti  0  7.16          Composition
Zr  0  3.438          Composition
*  0  0          * 0 0 to specify end of composition input
SameAsBeam          Geometry
0.1  0.1          Upstream and downstream thicknesses [cm]
0  10          Angle of rotation and sample width (cm)
-0.0542          Density atoms/Å^3?
TRANSMISSION          Total cross section source
1.0          Tweak factor
1.0  0.0          Sample environment scattering fraction and attenuation coefficient [per A]

}

GO          


END          
1
Date and time last written:  20210211 09:31:12          
N