#------------------------------------------------------------------------------
#$Date: 2018-07-20 15:02:54 +0300 (Fri, 20 Jul 2018) $
#$Revision: 1269 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500014.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_3500014
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 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            Sc2O3.rod
_rod_data_source.block           1000005
_rod_database.code               3500014
_solsa_sample.id                 CN-AA00-0015
_raman_measurement.datetime_initiated 2017-09-18
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
5.017309e+001 -8.963396e+001
5.113732e+001 -9.132391e+001
5.210155e+001 -9.376604e+001
5.306579e+001 -9.611000e+001
5.403002e+001 -9.739807e+001
5.499426e+001 -9.596109e+001
5.595849e+001 -9.339687e+001
5.692272e+001 -8.971901e+001
5.788696e+001 -8.554636e+001
5.885119e+001 -8.195187e+001
5.981542e+001 -8.379156e+001
6.077965e+001 -8.928974e+001
6.174389e+001 -9.473338e+001
6.270812e+001 -9.834104e+001
6.367235e+001 -9.961729e+001
6.463658e+001 -9.998307e+001
6.560081e+001 -9.871505e+001
6.656505e+001 -9.670161e+001
6.752928e+001 -9.502843e+001
6.849352e+001 -9.554641e+001
6.945775e+001 -9.559427e+001
7.042198e+001 -9.433974e+001
7.138622e+001 -9.259547e+001
7.235045e+001 -9.169380e+001
7.331468e+001 -9.181510e+001
7.427892e+001 -9.232172e+001
7.524315e+001 -9.380396e+001
7.620738e+001 -9.616484e+001
7.717162e+001 -9.858599e+001
7.813585e+001 -9.925599e+001
7.910008e+001 -9.910234e+001
8.006432e+001 -9.828125e+001
8.102855e+001 -9.677505e+001
8.199278e+001 -9.390260e+001
8.295702e+001 -9.223828e+001
8.392125e+001 -9.283969e+001
8.488548e+001 -9.476563e+001
8.584972e+001 -9.655776e+001
8.681395e+001 -9.819714e+001
8.777818e+001 -9.910875e+001
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9.067088e+001 -9.371505e+001
9.163512e+001 -9.483708e+001
9.259935e+001 -9.652370e+001
9.356358e+001 -9.816276e+001
9.452782e+001 -9.930021e+001
9.549205e+001 -9.953052e+001
9.645628e+001 -9.853750e+001
9.742052e+001 -9.736662e+001
9.838475e+001 -9.682422e+001
9.934898e+001 -9.757151e+001
1.003132e+002 -9.971740e+001
1.012775e+002 -1.009255e+002
1.022417e+002 -1.009016e+002
1.032059e+002 -1.002193e+002
1.041701e+002 -9.990297e+001
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1.118840e+002 -1.016374e+002
1.128482e+002 -9.851875e+001
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1.205621e+002 -9.469489e+001
1.215263e+002 -9.296162e+001
1.224906e+002 -9.169802e+001
1.234548e+002 -9.088125e+001
1.244190e+002 -8.919458e+001
1.253833e+002 -8.633068e+001
1.263475e+002 -8.243557e+001
1.273117e+002 -7.813208e+001
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1.292402e+002 -6.846219e+001
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1.359898e+002 -6.813510e+001
1.369541e+002 -6.697781e+001
1.379183e+002 -6.502078e+001
1.388825e+002 -6.296734e+001
1.398468e+002 -6.130005e+001
1.408110e+002 -6.047068e+001
1.417752e+002 -6.099776e+001
1.427395e+002 -6.300323e+001
1.437037e+002 -6.630776e+001
1.446679e+002 -7.015682e+001
1.456322e+002 -7.336990e+001
1.465964e+002 -7.618094e+001
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1.485249e+002 -8.137771e+001
1.494891e+002 -8.387766e+001
1.504533e+002 -8.666662e+001
1.514176e+002 -9.002745e+001
1.523818e+002 -9.236885e+001
1.533460e+002 -9.291219e+001
1.543103e+002 -9.165369e+001
1.552745e+002 -8.995396e+001
1.562387e+002 -9.042120e+001
1.572030e+002 -9.174750e+001
1.581672e+002 -9.273312e+001
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1.600957e+002 -9.126573e+001
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2.121642e+002 -6.464588e+001
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2.198781e+002 5.967708e-001
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loop_
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_rod_maintainer_comment.text
1 elmendili 2017-10-06T15:24:15+0300 'Mineral name changed'