#------------------------------------------------------------------------------
#$Date: 2017-09-21 15:28:33 +0300 (Thu, 21 Sep 2017) $
#$Revision: 188 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500052.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_3500052
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of commercial H3BO3
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial Prolabo 99%'
_chemical_formula_structural     'B H3 O3'
_chemical_formula_sum            'B H3 O3'
_chemical_name_mineral           'Boric acid'
_chemical_name_systematic        'orthoboric acid'
_space_group_IT_number           145
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  'P 32'
_symmetry_space_group_name_H-M   'P 32'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   7.0453(4)
_cell_length_b                   7.0453(4)
_cell_length_c                   9.5608(7)
_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.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 30
_raman_measurement.range_min     50.17309
_raman_measurement.range_max     2249.589
_rod_data_source.file            H3BO3.rod
_rod_data_source.block           1000005
_rod_database.code               3500052
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 2013259 COD http://www.crystallography.net/cod/2013259.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
5.017309e+001 5.551078e+001
5.113732e+001 5.294291e+001
5.210155e+001 4.927576e+001
5.306579e+001 4.559460e+001
5.403002e+001 4.288950e+001
5.499426e+001 4.220427e+001
5.595849e+001 4.328706e+001
5.692272e+001 4.708320e+001
5.788696e+001 5.276147e+001
5.885119e+001 5.860627e+001
5.981542e+001 5.892093e+001
6.077965e+001 5.554790e+001
6.174389e+001 5.123200e+001
6.270812e+001 4.715602e+001
6.367235e+001 4.336341e+001
6.463658e+001 4.165369e+001
6.560081e+001 4.260680e+001
6.656505e+001 4.465278e+001
6.752928e+001 4.632956e+001
6.849352e+001 4.673665e+001
6.945775e+001 4.736123e+001
7.042198e+001 4.868364e+001
7.138622e+001 5.025381e+001
7.235045e+001 5.133071e+001
7.331468e+001 5.175653e+001
7.427892e+001 5.167975e+001
7.524315e+001 5.088773e+001
7.620738e+001 4.938472e+001
7.717162e+001 4.737786e+001
7.813585e+001 4.419074e+001
7.910008e+001 4.097966e+001
8.006432e+001 3.951919e+001
8.102855e+001 4.112257e+001
8.199278e+001 4.629635e+001
8.295702e+001 5.001343e+001
8.392125e+001 5.209925e+001
8.488548e+001 5.276741e+001
8.584972e+001 5.227542e+001
8.681395e+001 4.872699e+001
8.777818e+001 4.665955e+001
8.874242e+001 4.697438e+001
8.970665e+001 4.915760e+001
9.067088e+001 5.142523e+001
9.163512e+001 5.237757e+001
9.259935e+001 5.327492e+001
9.356358e+001 5.425677e+001
9.452782e+001 5.555762e+001
9.549205e+001 5.778779e+001
9.645628e+001 6.161509e+001
9.742052e+001 6.634141e+001
9.838475e+001 7.178674e+001
9.934898e+001 7.779147e+001
1.003132e+002 8.403361e+001
1.012775e+002 8.899871e+001
1.022417e+002 9.288880e+001
1.032059e+002 9.620573e+001
1.041701e+002 9.973418e+001
1.051344e+002 1.047757e+002
1.060986e+002 1.088705e+002
1.070628e+002 1.107420e+002
1.080271e+002 1.110064e+002
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1.128482e+002 1.464980e+002
1.138125e+002 1.676236e+002
1.147767e+002 1.955762e+002
1.157409e+002 2.246898e+002
1.167052e+002 2.524528e+002
1.176694e+002 2.768761e+002
1.186336e+002 2.953066e+002
1.195979e+002 3.020938e+002
1.205621e+002 2.985967e+002
1.215263e+002 2.874196e+002
1.224906e+002 2.722859e+002
1.234548e+002 2.491234e+002
1.244190e+002 2.317739e+002
1.253833e+002 2.203897e+002
1.263475e+002 2.147858e+002
1.273117e+002 2.142837e+002
1.282760e+002 2.231436e+002
1.292402e+002 2.331658e+002
1.302044e+002 2.453563e+002
1.311687e+002 2.589323e+002
1.321329e+002 2.677001e+002
1.330971e+002 2.674547e+002
1.340614e+002 2.610914e+002
1.350256e+002 2.482897e+002
1.359898e+002 2.291043e+002
1.369541e+002 2.061498e+002
1.379183e+002 1.846288e+002
1.388825e+002 1.642011e+002
1.398468e+002 1.449028e+002
1.408110e+002 1.268519e+002
1.417752e+002 1.102531e+002
1.427395e+002 9.624460e+001
1.437037e+002 8.564822e+001
1.446679e+002 7.763102e+001
1.456322e+002 7.007445e+001
1.465964e+002 6.226647e+001
1.475606e+002 5.551986e+001
1.485249e+002 4.996452e+001
1.494891e+002 4.557853e+001
1.504533e+002 4.210408e+001
1.514176e+002 4.056979e+001
1.523818e+002 3.954756e+001
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1.543103e+002 3.761917e+001
1.552745e+002 3.622461e+001
1.562387e+002 3.385226e+001
1.572030e+002 3.114761e+001
1.581672e+002 2.869254e+001
1.591314e+002 2.693093e+001
1.600957e+002 2.587918e+001
1.610599e+002 2.589398e+001
1.620241e+002 2.738647e+001
1.629884e+002 2.916247e+001
1.639526e+002 2.977900e+001
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1.658811e+002 2.723278e+001
1.668453e+002 2.601592e+001
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1.697380e+002 2.237814e+001
1.707022e+002 2.170342e+001
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1.726307e+002 2.255701e+001
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2.054146e+002 1.752218e+002
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2.112000e+002 2.763621e+002
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2.131285e+002 2.458475e+002
2.140927e+002 2.183889e+002
2.150569e+002 1.886948e+002
2.160212e+002 1.608326e+002
2.169854e+002 1.358883e+002
2.179496e+002 1.159516e+002
2.189139e+002 1.009995e+002
2.198781e+002 8.940889e+001
2.208423e+002 7.887606e+001
2.218066e+002 6.889354e+001
2.227708e+002 6.120324e+001
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2.806248e+002 6.177897e-001
2.815891e+002 -1.638509e-001
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2.835175e+002 9.854818e-001
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2.248625e+003 6.756942e+000
2.249589e+003 6.434204e+000