#------------------------------------------------------------------------------
#$Date: 2018-07-20 15:02:54 +0300 (Fri, 20 Jul 2018) $
#$Revision: 1269 $
#$URL: svn://172.16.1.111/rod/cif/3/50/01/3500142.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_3500142
loop_
_publ_author_name
'El Mendili, Y.'
_publ_section_title
;
 Raman spectrum of commercial scandium(III) oxide
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial powder Chempur 99.9%'
_chemical_formula_structural     'O3 Sc2'
_chemical_formula_sum            'O3 Sc2'
_chemical_name_mineral           Scandia
_chemical_name_systematic        'scandium(III) oxide'
_space_group_IT_number           206
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-I 2b 2c 3'
_symmetry_space_group_name_H-M   'I a -3'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            16
_cell_length_a                   9.8349
_cell_length_b                   9.8349
_cell_length_c                   9.8349
_raman_determination_method      experimental
_[local]_chemical_compound_color white
_[local]_chemical_compound_state Solid
_raman_measurement_device.location ENSICAEN
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.model  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 785
_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     5.050586e+001
_raman_measurement.range_max     3.369397e+003
_rod_data_source.file            Sc2O3.rod
_rod_data_source.block           1000005
_rod_database.code               3500142
_solsa_sample.id                 CN-AA00-0105
_raman_measurement.datetime_initiated 2017-10-10
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 4501808 COD http://www.crystallography.net/cod/4501808.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
5.050586e+001 -5.011267e+001
5.147009e+001 -6.261060e+001
5.243433e+001 -8.215515e+001
5.339856e+001 -9.755652e+001
5.436279e+001 -9.944775e+001
5.532703e+001 -8.867212e+001
5.629126e+001 -7.779602e+001
5.725549e+001 -6.989246e+001
5.821973e+001 -6.499146e+001
5.918396e+001 -6.115808e+001
6.014819e+001 -5.397217e+001
6.111243e+001 -4.542542e+001
6.207666e+001 -3.930652e+001
6.304089e+001 -3.409888e+001
6.400513e+001 -2.818542e+001
6.496936e+001 -2.282642e+001
6.593359e+001 -1.849890e+001
6.689783e+001 -1.635815e+001
6.786206e+001 -2.043811e+001
6.882629e+001 -3.120923e+001
6.979053e+001 -4.011108e+001
7.075476e+001 -4.295654e+001
7.171899e+001 -3.960791e+001
7.268323e+001 -3.329431e+001
7.364746e+001 -2.656677e+001
7.461169e+001 -2.057593e+001
7.557593e+001 -1.598315e+001
7.654016e+001 -1.406799e+001
7.750439e+001 -1.674207e+001
7.846863e+001 -2.065515e+001
7.943286e+001 -2.310303e+001
8.039709e+001 -2.415430e+001
8.136133e+001 -2.491028e+001
8.232556e+001 -2.551355e+001
8.328979e+001 -2.403992e+001
8.425403e+001 -1.811499e+001
8.521826e+001 -9.916016e+000
8.618250e+001 -3.822510e+000
8.714673e+001 -2.412476e+000
8.811096e+001 -1.692383e+000
8.907520e+001 3.380249e+000
9.003943e+001 1.345850e+001
9.100366e+001 2.223181e+001
9.196790e+001 2.100293e+001
9.293213e+001 7.520020e+000
9.389636e+001 -4.583618e+000
9.486060e+001 -5.385864e+000
9.582483e+001 2.417236e+000
9.678906e+001 7.282715e+000
9.775330e+001 5.933228e+000
9.871753e+001 3.045654e-001
9.968176e+001 -5.287354e+000
1.006460e+002 -1.442346e+001
1.016102e+002 -1.985754e+001
1.025745e+002 -1.170081e+001
1.035387e+002 1.183765e+001
1.045029e+002 3.557593e+001
1.054672e+002 4.177332e+001
1.064314e+002 2.810632e+001
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1.083599e+002 2.017822e+000
1.093241e+002 -5.588989e+000
1.102883e+002 -9.106812e+000
1.112526e+002 -6.628906e+000
1.122168e+002 -1.304932e-001
1.131810e+002 3.159912e+000
1.141453e+002 1.967896e+000
1.151095e+002 -1.248413e+000
1.160737e+002 -7.830566e+000
1.170380e+002 -1.636157e+001
1.180022e+002 -2.050317e+001
1.189664e+002 -1.562842e+001
1.199307e+002 -1.864380e+000
1.208949e+002 9.993774e+000
1.218591e+002 2.271655e+001
1.228234e+002 3.237268e+001
1.237876e+002 3.407288e+001
1.247518e+002 2.695520e+001
1.257161e+002 1.705920e+001
1.266803e+002 1.443237e+001
1.276445e+002 2.429517e+001
1.286088e+002 3.139429e+001
1.295730e+002 3.212537e+001
1.305372e+002 2.921729e+001
1.315015e+002 2.740784e+001
1.324657e+002 2.988428e+001
1.334299e+002 3.698486e+001
1.343942e+002 4.257996e+001
1.353584e+002 4.319397e+001
1.363226e+002 4.401953e+001
1.372869e+002 4.846545e+001
1.382511e+002 5.604871e+001
1.392153e+002 6.339624e+001
1.401796e+002 6.728198e+001
1.411438e+002 6.898425e+001
1.421080e+002 6.764966e+001
1.430723e+002 6.286438e+001
1.440365e+002 5.851270e+001
1.450007e+002 5.745007e+001
1.459650e+002 6.125684e+001
1.469292e+002 6.938086e+001
1.478934e+002 7.621350e+001
1.488577e+002 7.473669e+001
1.498219e+002 7.494763e+001
1.507861e+002 7.874512e+001
1.517504e+002 8.504797e+001
1.527146e+002 9.213525e+001
1.536788e+002 1.014015e+002
1.546431e+002 1.161138e+002
1.556073e+002 1.204005e+002
1.565715e+002 9.854321e+001
1.575358e+002 7.674536e+001
1.585000e+002 7.128906e+001
1.594642e+002 8.756689e+001
1.604285e+002 1.133801e+002
1.613927e+002 1.294791e+002
1.623569e+002 1.316563e+002
1.633212e+002 1.328077e+002
1.642854e+002 1.358824e+002
1.652496e+002 1.409191e+002
1.662139e+002 1.481915e+002
1.671781e+002 1.604735e+002
1.681423e+002 1.751881e+002
1.691066e+002 1.843614e+002
1.700708e+002 1.865370e+002
1.710350e+002 1.852375e+002
1.719993e+002 1.837522e+002
1.729635e+002 1.822762e+002
1.739277e+002 1.791628e+002
1.748920e+002 1.732494e+002
1.758562e+002 1.654672e+002
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1.854986e+002 1.512421e+002
1.864628e+002 1.811724e+002
1.874270e+002 2.065480e+002
1.883913e+002 2.382330e+002
1.893555e+002 2.609476e+002
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1.951409e+002 1.065520e+002
1.961051e+002 9.401678e+001
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2.028548e+002 4.714679e+001
2.038190e+002 4.261542e+001
2.047832e+002 3.698077e+001
2.057475e+002 3.325568e+001
2.067117e+002 3.385083e+001
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2.086402e+002 4.465204e+001
2.096044e+002 4.975812e+001
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2.115329e+002 5.391327e+001
2.124971e+002 5.395758e+001
2.134613e+002 5.256287e+001
2.144256e+002 4.776978e+001
2.153898e+002 3.833521e+001
2.163540e+002 2.993274e+001
2.173183e+002 2.828021e+001
2.182825e+002 3.041833e+001
2.192467e+002 3.028931e+001
2.202110e+002 2.550079e+001
2.211752e+002 2.107715e+001
2.221394e+002 2.089502e+001
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2.240679e+002 2.821185e+001
2.250321e+002 3.501166e+001
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2.288891e+002 3.903052e+001
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2.481737e+002 4.185211e+001
2.491380e+002 5.072302e+001
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2.568518e+002 4.119983e+001
2.578160e+002 4.010120e+001
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2.684226e+002 3.803839e+001
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2.703511e+002 7.553024e+001
2.713153e+002 9.883478e+001
2.722795e+002 1.138025e+002
2.732438e+002 1.148632e+002
2.742080e+002 1.133334e+002
2.751722e+002 1.124019e+002
2.761365e+002 1.092642e+002
2.771007e+002 1.030374e+002
2.780649e+002 9.624039e+001
2.790292e+002 8.893311e+001
2.799934e+002 7.753839e+001
2.809576e+002 6.202020e+001
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2.867430e+002 6.126587e+001
2.877073e+002 4.606876e+001
2.886715e+002 3.271463e+001
2.896357e+002 2.569104e+001
2.906000e+002 3.052988e+001
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2.925284e+002 6.333646e+001
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3.050635e+002 3.686890e+000
3.060277e+002 -4.382629e-001
3.069920e+002 9.240417e-001
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