#------------------------------------------------------------------------------
#$Date: 2018-07-20 15:02:54 +0300 (Fri, 20 Jul 2018) $
#$Revision: 1269 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500010.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_3500010
loop_
_publ_author_name
'El Mendili, Y.'
_publ_section_title
;
 Raman spectrum of commercial potassium trialuminium hexahydro disulfate
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial powder Alfa Aesar 99.9%'
_chemical_formula_structural     'Al3 H6 K O14 S2'
_chemical_formula_sum            'Al3 H6 K O14 S2'
_chemical_name_mineral           Alunite
_chemical_name_systematic        'potassium trialuminium hexahydro disulfate'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   7.020
_cell_length_b                   7.020
_cell_length_c                   17.223
_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 9
_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 1200
_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 60
_raman_measurement.range_min     114.9695
_raman_measurement.range_max     6000.65
_rod_data_source.file            Alunite.rod
_rod_data_source.block           1000005
_rod_database.code               3500010
_solsa_sample.id                 CN-AA00-0011
_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 9009284 COD http://www.crystallography.net/cod/9009284.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
1.149695e+002 2.536191e+001
1.159337e+002 2.803692e+001
1.168979e+002 3.057812e+001
1.178622e+002 3.288211e+001
1.188264e+002 3.494572e+001
1.197906e+002 3.681346e+001
1.207549e+002 3.847126e+001
1.217191e+002 3.990903e+001
1.226833e+002 4.109940e+001
1.236476e+002 4.208162e+001
1.246118e+002 4.287697e+001
1.255760e+002 4.348450e+001
1.265403e+002 4.389992e+001
1.275045e+002 4.379874e+001
1.284688e+002 4.355176e+001
1.294330e+002 4.322021e+001
1.303972e+002 4.283352e+001
1.313615e+002 4.238963e+001
1.323257e+002 4.187035e+001
1.332899e+002 4.117229e+001
1.342542e+002 4.039594e+001
1.352184e+002 3.961897e+001
1.361826e+002 3.886472e+001
1.371469e+002 3.813298e+001
1.381111e+002 3.741545e+001
1.390753e+002 3.659147e+001
1.400396e+002 3.559978e+001
1.410038e+002 3.478410e+001
1.419680e+002 3.413790e+001
1.429323e+002 3.363847e+001
1.438965e+002 3.329924e+001
1.448607e+002 3.314160e+001
1.458250e+002 3.332800e+001
1.467892e+002 3.358178e+001
1.477534e+002 3.389842e+001
1.487177e+002 3.427557e+001
1.496819e+002 3.471775e+001
1.506461e+002 3.540137e+001
1.516104e+002 3.635069e+001
1.525746e+002 3.730048e+001
1.535388e+002 3.812292e+001
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1.554673e+002 3.933424e+001
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1.583600e+002 4.000502e+001
1.593242e+002 3.998080e+001
1.602885e+002 3.983563e+001
1.612527e+002 3.959280e+001
1.622169e+002 3.912413e+001
1.631812e+002 3.835589e+001
1.641454e+002 3.741835e+001
1.651096e+002 3.660737e+001
1.660739e+002 3.590326e+001
1.670381e+002 3.530712e+001
1.680023e+002 3.483871e+001
1.689666e+002 3.470213e+001
1.699308e+002 3.466869e+001
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1.718593e+002 3.461275e+001
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1.786089e+002 3.393068e+001
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1.805374e+002 3.380176e+001
1.815016e+002 3.374697e+001
1.824658e+002 3.371970e+001
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1.853585e+002 3.384634e+001
1.863228e+002 3.396621e+001
1.872870e+002 3.416642e+001
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1.892155e+002 3.457336e+001
1.901797e+002 3.477949e+001
1.911439e+002 3.499757e+001
1.921082e+002 3.525938e+001
1.930724e+002 3.566250e+001
1.940366e+002 3.599893e+001
1.950009e+002 3.625072e+001
1.959651e+002 3.641896e+001
1.969293e+002 3.649316e+001
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1.988578e+002 3.599553e+001
1.998220e+002 3.558274e+001
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2.017505e+002 3.491099e+001
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2.085001e+002 3.428202e+001
2.094644e+002 3.433976e+001
2.104286e+002 3.437904e+001
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2.133213e+002 3.493414e+001
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2.152498e+002 3.581774e+001
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2.248921e+002 4.261608e+001
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2.268206e+002 4.302411e+001
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2.297133e+002 4.300101e+001
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2.866030e+002 2.100325e+001
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