#------------------------------------------------------------------------------ #$Date: 2017-11-22 18:04:43 +0200 (Wed, 22 Nov 2017) $ #$Revision: 353 $ #$URL: svn://172.16.1.111/rod/cif/3/50/01/3500155.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_3500155 loop_ _publ_author_name 'El Mendili, Y' _publ_section_title ; Raman spectrum of commercial Hematite ; _journal_name_full 'Personal communication to ROD' _journal_year 2017 _chemical_compound_source 'commercial powder Alfa aesar 98% 12375' _chemical_formula_structural 'Fe2 O3' _chemical_formula_sum 'Fe2 O3' _chemical_name_mineral Hematite _chemical_name_systematic 'Fe2 O3' _space_group_crystal_system trigonal _space_group_IT_number 167 _space_group_name_Hall '-R 3 2"c' _space_group_name_H-M_alt 'R -3 c :H' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 6 _cell_length_a 5.03 _cell_length_b 5.03 _cell_length_c 13.75 _raman_determination_method experimental _[local]_chemical_compound_color red _[local]_chemical_compound_state Solid _solsa_sample.id CN-AA00-0069 _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 180 _raman_measurement.range_min 5.036682e+001 _raman_measurement.range_max 2.500483e+003 _rod_data_source.file Hematite532nm.rod _rod_data_source.block 1000005 _rod_database.code 3500155 _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 1546383 COD http://www.crystallography.net/cod/1546383.html ; The structure contains the XRD analysis data. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 5.036682e+001 7.913755e+000 5.133105e+001 6.668856e+000 5.229529e+001 5.319799e+000 5.325952e+001 4.138744e+000 5.422375e+001 3.410805e+000 5.518799e+001 3.171764e+000 5.615222e+001 3.092125e+000 5.711646e+001 2.756739e+000 5.808069e+001 2.050732e+000 5.904492e+001 1.520176e+000 6.000916e+001 1.443739e+000 6.097339e+001 1.640266e+000 6.193762e+001 1.702055e+000 6.290186e+001 1.374950e+000 6.386609e+001 7.271748e-001 6.483032e+001 3.289328e-001 6.579456e+001 3.924093e-001 6.675879e+001 5.499830e-001 6.772302e+001 5.227375e-001 6.868726e+001 2.673931e-001 6.965149e+001 -4.694748e-002 7.061572e+001 -2.421551e-001 7.157996e+001 -2.960129e-001 7.254419e+001 -3.498631e-001 7.350842e+001 -4.240379e-001 7.447266e+001 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