#------------------------------------------------------------------------------
#$Date: 2018-01-05 14:55:17 +0200 (Fri, 05 Jan 2018) $
#$Revision: 361 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500046.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_3500046
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of commercial CuSO4
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial ACROS 98%'
_chemical_formula_structural     'Cu O4 S'
_chemical_formula_sum            'Cu O4 S'
_chemical_name_mineral           Chalcocyanite
_chemical_name_systematic        Chalcocyanite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.409
_cell_length_b                   6.709
_cell_length_c                   4.833
_raman_determination_method      experimental
_[local]_chemical_compound_color blue
_[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 30
_raman_measurement.range_min     50.17309
_raman_measurement.range_max     2500.290
_rod_data_source.file            CuSO4.rod
_rod_data_source.block           1000005
_rod_database.code               3500046
_solsa_sample.id                 CN-AA00-0035
_raman_measurement.datetime_initiated 2017-09-20
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 9009830 COD http://www.crystallography.net/cod/9009830.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
5.017309e+001 1.092847e+002
5.113732e+001 1.087230e+002
5.210155e+001 1.073608e+002
5.306579e+001 1.066165e+002
5.403002e+001 1.077598e+002
5.499426e+001 1.119488e+002
5.595849e+001 1.199101e+002
5.692272e+001 1.321219e+002
5.788696e+001 1.482885e+002
5.885119e+001 1.675370e+002
5.981542e+001 1.870381e+002
6.077965e+001 2.071773e+002
6.174389e+001 2.301099e+002
6.270812e+001 2.567292e+002
6.367235e+001 2.871667e+002
6.463658e+001 3.303059e+002
6.560081e+001 3.927364e+002
6.656505e+001 4.591755e+002
6.752928e+001 5.180656e+002
6.849352e+001 5.731176e+002
6.945775e+001 6.045095e+002
7.042198e+001 6.101134e+002
7.138622e+001 5.940548e+002
7.235045e+001 5.636644e+002
7.331468e+001 5.141443e+002
7.427892e+001 4.598783e+002
7.524315e+001 4.026340e+002
7.620738e+001 3.443616e+002
7.717162e+001 2.875143e+002
7.813585e+001 2.356005e+002
7.910008e+001 1.887449e+002
8.006432e+001 1.502489e+002
8.102855e+001 1.224834e+002
8.199278e+001 1.073337e+002
8.295702e+001 9.517119e+001
8.392125e+001 8.529158e+001
8.488548e+001 7.657265e+001
8.584972e+001 6.747957e+001
8.681395e+001 5.580127e+001
8.777818e+001 4.776756e+001
8.874242e+001 4.509170e+001
8.970665e+001 4.671301e+001
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9.742052e+001 6.126843e+001
9.838475e+001 6.728550e+001
9.934898e+001 7.538391e+001
1.003132e+002 8.593770e+001
1.012775e+002 9.920383e+001
1.022417e+002 1.150392e+002
1.032059e+002 1.336978e+002
1.041701e+002 1.558143e+002
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1.244190e+002 2.268822e+002
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1.273117e+002 2.603083e+002
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1.302044e+002 2.707606e+002
1.311687e+002 2.696873e+002
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1.437037e+002 2.198669e+002
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1.456322e+002 1.926927e+002
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1.485249e+002 1.646195e+002
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1.504533e+002 1.391362e+002
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1.572030e+002 1.030141e+002
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1.639526e+002 8.849536e+001
1.649168e+002 8.852840e+001
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2.208423e+002 4.664247e+002
2.218066e+002 4.524276e+002
2.227708e+002 4.366870e+002
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2.758036e+002 9.788031e+002
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