#------------------------------------------------------------------------------
#$Date: 2017-10-13 10:51:32 +0300 (Fri, 13 Oct 2017) $
#$Revision: 253 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500080.rod $
#------------------------------------------------------------------------------
#
# This file is available in the Raman Open Database (ROD),
# http://solsa.crystallography.net/rod/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_3500080
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of commercial Hematite
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial powder Alfa aesar 98% 12375'
_chemical_formula_structural     'Fe2 O3'
_chemical_formula_sum            'Fe2 O3'
_chemical_name_mineral           Hematite
_chemical_name_systematic        'Fe2 O3'
_space_group_crystal_system      trigonal
_space_group_IT_number           167
_space_group_name_Hall           '-R 3 2"c'
_space_group_name_H-M_alt        'R -3 c :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   5.03
_cell_length_b                   5.03
_cell_length_c                   13.75
_raman_determination_method      experimental
_[local]_chemical_compound_color red
_[local]_chemical_compound_state Solid
_solsa_sample.id                 CN-NC00-0069
_raman_measurement_device.location ENSICAEN
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.name   DXR
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 20
_raman_measurement_device.microscope_numerical_aperture 0.25
_raman_measurement_device.excitation_laser_type other
_raman_measurement_device.excitation_laser_wavelength 532
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 3
_raman_measurement_device.power_on_sample 1
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1.3
_raman_measurement_device.diffraction_grating 900
_raman_measurement.environment   Air
_raman_measurement.environment_details
;
 The sample was measured in air.
;
_raman_measurement.temperature   300
_raman_measurement.pressure      100
_raman_measurement.background_subtraction no
_raman_measurement.background_subtraction_details
;
 No background subtraction method was applied.
;
_raman_measurement.baseline_correction no
_raman_measurement.baseline_correction_details
;
 No baseline correction method was applied.
;
_raman_measurement.integration_time 180
_raman_measurement.range_min     50.17309
_raman_measurement.range_max     2500.29
_rod_data_source.file            Hematite532nm.rod
_rod_data_source.block           1000005
_rod_database.code               3500080
loop_
_raman_complementary.id
_raman_complementary.method
1 EDX
loop_
_raman_measurement_device_calibration.id
_raman_measurement_device_calibration.standard
1 neon_lamp
loop_
_rod_related_entry.id
_rod_related_entry.code
_rod_related_entry.database
_rod_related_entry.uri
_rod_related_entry.description
1 1546383 COD http://www.crystallography.net/cod/1546383.html
;
 The structure contains the XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
5.017309e+001 3.154578e+001
5.113732e+001 3.090448e+001
5.210155e+001 2.992240e+001
5.306579e+001 2.868172e+001
5.403002e+001 2.721741e+001
5.499426e+001 2.536731e+001
5.595849e+001 2.382498e+001
5.692272e+001 2.311223e+001
5.788696e+001 2.317619e+001
5.885119e+001 2.373283e+001
5.981542e+001 2.406377e+001
6.077965e+001 2.404973e+001
6.174389e+001 2.365730e+001
6.270812e+001 2.288107e+001
6.367235e+001 2.174392e+001
6.463658e+001 2.082699e+001
6.560081e+001 2.033530e+001
6.656505e+001 2.002964e+001
6.752928e+001 1.958291e+001
6.849352e+001 1.830897e+001
6.945775e+001 1.741850e+001
7.042198e+001 1.717809e+001
7.138622e+001 1.732794e+001
7.235045e+001 1.742738e+001
7.331468e+001 1.759036e+001
7.427892e+001 1.766010e+001
7.524315e+001 1.748210e+001
7.620738e+001 1.701302e+001
7.717162e+001 1.630058e+001
7.813585e+001 1.514141e+001
7.910008e+001 1.384265e+001
8.006432e+001 1.280535e+001
8.102855e+001 1.235982e+001
8.199278e+001 1.277131e+001
8.295702e+001 1.379804e+001
8.392125e+001 1.541852e+001
8.488548e+001 1.692410e+001
8.584972e+001 1.737051e+001
8.681395e+001 1.545556e+001
8.777818e+001 1.413603e+001
8.874242e+001 1.392434e+001
8.970665e+001 1.457730e+001
9.067088e+001 1.518251e+001
9.163512e+001 1.475474e+001
9.259935e+001 1.432641e+001
9.356358e+001 1.429463e+001
9.452782e+001 1.480946e+001
9.549205e+001 1.558377e+001
9.645628e+001 1.606480e+001
9.742052e+001 1.632831e+001
9.838475e+001 1.641126e+001
9.934898e+001 1.635011e+001
1.003132e+002 1.609551e+001
1.012775e+002 1.590547e+001
1.022417e+002 1.584931e+001
1.032059e+002 1.597499e+001
1.041701e+002 1.633255e+001
1.051344e+002 1.749803e+001
1.060986e+002 1.857617e+001
1.070628e+002 1.935430e+001
1.080271e+002 1.982828e+001
1.089913e+002 2.022095e+001
1.099555e+002 2.044161e+001
1.109198e+002 2.070393e+001
1.118840e+002 2.117323e+001
1.128482e+002 2.189323e+001
1.138125e+002 2.257397e+001
1.147767e+002 2.290322e+001
1.157409e+002 2.293458e+001
1.167052e+002 2.270286e+001
1.176694e+002 2.226077e+001
1.186336e+002 2.165426e+001
1.195979e+002 2.080877e+001
1.205621e+002 1.969858e+001
1.215263e+002 1.852938e+001
1.224906e+002 1.763810e+001
1.234548e+002 1.736617e+001
1.244190e+002 1.715899e+001
1.253833e+002 1.707227e+001
1.263475e+002 1.709160e+001
1.273117e+002 1.712330e+001
1.282760e+002 1.701600e+001
1.292402e+002 1.682896e+001
1.302044e+002 1.652152e+001
1.311687e+002 1.608974e+001
1.321329e+002 1.561679e+001
1.330971e+002 1.530155e+001
1.340614e+002 1.496354e+001
1.350256e+002 1.446250e+001
1.359898e+002 1.375770e+001
1.369541e+002 1.328771e+001
1.379183e+002 1.376253e+001
1.388825e+002 1.477428e+001
1.398468e+002 1.585022e+001
1.408110e+002 1.647497e+001
1.417752e+002 1.642359e+001
1.427395e+002 1.599202e+001
1.437037e+002 1.496755e+001
1.446679e+002 1.384079e+001
1.456322e+002 1.357020e+001
1.465964e+002 1.506685e+001
1.475606e+002 1.641208e+001
1.485249e+002 1.752293e+001
1.494891e+002 1.832007e+001
1.504533e+002 1.872201e+001
1.514176e+002 1.836631e+001
1.523818e+002 1.813471e+001
1.533460e+002 1.845194e+001
1.543103e+002 1.937774e+001
1.552745e+002 2.029193e+001
1.562387e+002 1.987039e+001
1.572030e+002 1.882189e+001
1.581672e+002 1.770690e+001
1.591314e+002 1.695233e+001
1.600957e+002 1.655290e+001
1.610599e+002 1.709517e+001
1.620241e+002 1.894260e+001
1.629884e+002 2.102144e+001
1.639526e+002 2.202407e+001
1.649168e+002 2.113993e+001
1.658811e+002 2.048644e+001
1.668453e+002 1.999963e+001
1.678095e+002 1.963148e+001
1.687738e+002 1.933696e+001
1.697380e+002 1.924642e+001
1.707022e+002 1.925098e+001
1.716665e+002 1.925686e+001
1.726307e+002 1.923147e+001
1.735949e+002 1.917901e+001
1.745592e+002 1.930390e+001
1.755234e+002 1.945090e+001
1.764876e+002 1.939435e+001
1.774519e+002 1.906578e+001
1.784161e+002 1.853193e+001
1.793803e+002 1.837529e+001
1.803446e+002 1.851687e+001
1.813088e+002 1.867737e+001
1.822730e+002 1.863960e+001
1.832373e+002 1.824323e+001
1.842015e+002 1.821170e+001
1.851657e+002 1.883622e+001
1.861300e+002 1.968630e+001
1.870942e+002 2.042118e+001
1.880584e+002 2.087937e+001
1.890227e+002 2.109001e+001
1.899869e+002 2.085533e+001
1.909511e+002 2.045513e+001
1.919154e+002 2.023528e+001
1.928796e+002 2.066852e+001
1.938438e+002 2.106104e+001
1.948081e+002 2.080927e+001
1.957723e+002 2.008130e+001
1.967365e+002 1.926059e+001
1.977008e+002 1.912240e+001
1.986650e+002 1.963623e+001
1.996292e+002 2.014224e+001
2.005935e+002 2.052925e+001
2.015577e+002 2.078494e+001
2.025219e+002 2.090809e+001
2.034862e+002 2.019477e+001
2.044504e+002 2.048632e+001
2.054146e+002 2.273760e+001
2.063788e+002 2.704630e+001
2.073431e+002 2.996884e+001
2.083073e+002 2.953519e+001
2.092715e+002 2.841016e+001
2.102358e+002 2.778104e+001
2.112000e+002 2.836582e+001
2.121642e+002 3.018706e+001
2.131285e+002 3.275771e+001
2.140927e+002 3.579909e+001
2.150569e+002 3.918866e+001
2.160212e+002 4.285004e+001
2.169854e+002 4.683371e+001
2.179496e+002 5.105146e+001
2.189139e+002 5.550137e+001
2.198781e+002 5.999799e+001
2.208423e+002 6.436285e+001
2.218066e+002 6.940081e+001
2.227708e+002 7.239738e+001
2.237350e+002 7.327330e+001
2.246993e+002 7.261755e+001
2.256635e+002 7.131767e+001
2.266277e+002 6.875270e+001
2.275920e+002 6.589722e+001
2.285562e+002 6.302560e+001
2.295204e+002 6.023281e+001
2.304847e+002 5.747351e+001
2.314489e+002 5.449607e+001
2.324131e+002 5.172739e+001
2.333774e+002 4.958847e+001
2.343416e+002 4.814520e+001
2.353058e+002 4.724825e+001
2.362701e+002 4.620121e+001
2.372343e+002 4.490639e+001
2.381985e+002 4.407871e+001
2.391628e+002 4.412037e+001
2.401270e+002 4.510839e+001
2.410912e+002 4.516209e+001
2.420555e+002 4.434496e+001
2.430197e+002 4.346769e+001
2.439839e+002 4.277640e+001
2.449482e+002 4.224533e+001
2.459124e+002 4.160014e+001
2.468766e+002 4.061392e+001
2.478409e+002 3.946552e+001
2.488051e+002 3.830141e+001
2.497693e+002 3.725335e+001
2.507336e+002 3.629032e+001
2.516978e+002 3.515571e+001
2.526620e+002 3.399863e+001
2.536263e+002 3.307262e+001
2.545905e+002 3.262049e+001
2.555547e+002 3.260926e+001
2.565190e+002 3.219309e+001
2.574832e+002 3.140156e+001
2.584474e+002 3.062088e+001
2.594117e+002 3.033172e+001
2.603759e+002 3.068580e+001
2.613401e+002 3.107803e+001
2.623044e+002 3.131490e+001
2.632686e+002 3.169788e+001
2.642328e+002 3.271008e+001
2.651971e+002 3.513515e+001
2.661613e+002 3.757813e+001
2.671255e+002 3.928090e+001
2.680898e+002 4.041174e+001
2.690540e+002 4.147351e+001
2.700182e+002 4.325666e+001
2.709825e+002 4.546262e+001
2.719467e+002 4.755043e+001
2.729109e+002 4.955596e+001
2.738752e+002 5.174414e+001
2.748394e+002 5.483382e+001
2.758036e+002 5.876227e+001
2.767679e+002 6.250998e+001
2.777321e+002 6.556368e+001
2.786964e+002 6.815028e+001
2.796606e+002 7.229263e+001
2.806248e+002 7.942378e+001
2.815891e+002 8.658514e+001
2.825533e+002 9.308119e+001
2.835175e+002 9.883060e+001
2.844818e+002 1.047690e+002
2.854460e+002 1.124990e+002
2.864102e+002 1.197870e+002
2.873745e+002 1.260808e+002
2.883387e+002 1.311113e+002
2.893029e+002 1.349660e+002
2.902672e+002 1.367306e+002
2.912314e+002 1.368952e+002
2.921956e+002 1.358894e+002
2.931599e+002 1.340096e+002
2.941241e+002 1.313915e+002
2.950883e+002 1.274668e+002
2.960526e+002 1.221352e+002
2.970168e+002 1.167267e+002
2.979810e+002 1.119793e+002
2.989453e+002 1.080200e+002
2.999095e+002 1.036911e+002
3.008737e+002 9.924979e+001
3.018380e+002 9.464153e+001
3.028022e+002 8.955638e+001
3.037664e+002 8.369357e+001
3.047307e+002 7.833638e+001
3.056949e+002 7.441000e+001
3.066591e+002 7.113608e+001
3.076234e+002 6.799879e+001
3.085876e+002 6.463295e+001
3.095518e+002 6.111478e+001
3.105161e+002 5.768649e+001
3.114803e+002 5.438771e+001
3.124445e+002 5.143149e+001
3.134088e+002 4.905350e+001
3.143730e+002 4.742808e+001
3.153372e+002 4.530318e+001
3.163015e+002 4.234911e+001
3.172657e+002 3.956651e+001
3.182299e+002 3.790234e+001
3.191942e+002 3.786452e+001
3.201584e+002 3.699012e+001
3.211226e+002 3.457865e+001
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3.413715e+002 2.440777e+001
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3.433000e+002 2.381706e+001
3.442642e+002 2.318841e+001
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