#------------------------------------------------------------------------------
#$Date: 2017-11-22 18:01:11 +0200 (Wed, 22 Nov 2017) $
#$Revision: 319 $
#$URL: svn://172.16.1.111/rod/cif/3/50/01/3500121.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_3500121
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of commercial FeSO4
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial Aldrich 99%'
_chemical_formula_structural     'Fe O4 S'
_chemical_formula_sum            'Fe O4 S'
_chemical_name_mineral           'Iron(II) sulfate'
_chemical_name_systematic        'Iron(II) sulfate'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.7042(8)
_cell_length_b                   6.8013(5)
_cell_length_c                   4.7868(5)
_raman_determination_method      experimental
_[local]_chemical_compound_color green
_[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 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 30
_raman_measurement.range_min     5.050586e+001
_raman_measurement.range_max     2.000186e+003
_rod_data_source.file            FeSO4.rod
_rod_data_source.block           1000005
_rod_database.code               3500121
_solsa_sample.id                 CN-AA00-0128
_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 2216658 COD http://www.crystallography.net/cod/2216658.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
5.050586e+001 1.567879e+001
5.147009e+001 1.460270e+001
5.243433e+001 1.360793e+001
5.339856e+001 1.258307e+001
5.436279e+001 1.144809e+001
5.532703e+001 1.020981e+001
5.629126e+001 8.997821e+000
5.725549e+001 7.890668e+000
5.821973e+001 6.846424e+000
5.918396e+001 5.814260e+000
6.014819e+001 4.762056e+000
6.111243e+001 3.758574e+000
6.207666e+001 2.898769e+000
6.304089e+001 2.190173e+000
6.400513e+001 1.680112e+000
6.496936e+001 1.395217e+000
6.593359e+001 1.328125e+000
6.689783e+001 1.298748e+000
6.786206e+001 1.160668e+000
6.882629e+001 9.136925e-001
6.979053e+001 7.348690e-001
7.075476e+001 7.403107e-001
7.171899e+001 8.710780e-001
7.268323e+001 9.984354e-001
7.364746e+001 1.092394e+000
7.461169e+001 1.131731e+000
7.557593e+001 1.043907e+000
7.654016e+001 7.234453e-001
7.750439e+001 4.475313e-001
7.846863e+001 5.739650e-001
7.943286e+001 1.124215e+000
8.039709e+001 1.657920e+000
8.136133e+001 1.975617e+000
8.232556e+001 2.079460e+000
8.328979e+001 1.991363e+000
8.425403e+001 1.577660e+000
8.521826e+001 1.018315e+000
8.618250e+001 6.319763e-001
8.714673e+001 4.355341e-001
8.811096e+001 4.438445e-001
8.907520e+001 7.570458e-001
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9.100366e+001 2.162932e+000
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9.678906e+001 1.882989e+000
9.775330e+001 1.826265e+000
9.871753e+001 1.851860e+000
9.968176e+001 2.008547e+000
1.006460e+002 2.348608e+000
1.016102e+002 2.798849e+000
1.025745e+002 3.376036e+000
1.035387e+002 4.102014e+000
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1.170380e+002 9.644611e-001
1.180022e+002 7.980888e-001
1.189664e+002 7.704902e-001
1.199307e+002 8.957520e-001
1.208949e+002 9.534155e-001
1.218591e+002 9.094676e-001
1.228234e+002 8.136886e-001
1.237876e+002 7.157937e-001
1.247518e+002 6.364983e-001
1.257161e+002 5.752978e-001
1.266803e+002 5.115052e-001
1.276445e+002 3.152055e-001
1.286088e+002 2.234752e-001
1.295730e+002 3.630030e-001
1.305372e+002 6.473225e-001
1.315015e+002 9.111830e-001
1.324657e+002 1.052359e+000
1.334299e+002 1.064693e+000
1.343942e+002 1.068390e+000
1.353584e+002 1.003637e+000
1.363226e+002 9.653040e-001
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1.401796e+002 1.446242e+000
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1.421080e+002 1.761944e+000
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1.440365e+002 1.446285e+000
1.450007e+002 1.395460e+000
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1.469292e+002 1.917188e+000
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1.488577e+002 2.560965e+000
1.498219e+002 2.849716e+000
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1.594642e+002 3.297850e+000
1.604285e+002 3.625330e+000
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