#------------------------------------------------------------------------------
#$Date: 2018-01-23 18:47:37 +0200 (Tue, 23 Jan 2018) $
#$Revision: 362 $
#$URL: svn://172.16.1.111/rod/cif/1/00/00/1000014.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_1000014
loop_
_publ_author_name
'El Mendili, Y'
'Abdelouas, A.'
'Ait Chaou, A'
'Bardeau, Jf'
'Schlegel, Ml'
_publ_section_title
;
 Carbon steel corrosion in clay-rich environment
;
_journal_name_full               'Corrosion Science'
_journal_page_first              56
_journal_page_last               65
_journal_volume                  88
_journal_year                    2014
_chemical_compound_source        'corrosion product'
_chemical_formula_structural     'Cl0.675 Fe4 O8'
_chemical_formula_sum            'Cl0.675 Fe4 O8'
_chemical_name_mineral           Akaganeite
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-I 2y'
_symmetry_space_group_name_H-M   'I 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.24
_cell_angle_gamma                90
_cell_length_a                   10.600
_cell_length_b                   3.0339
_cell_length_c                   10.513
_raman_determination_method      experimental
_[local]_chemical_compound_color white
_[local]_chemical_compound_state Solid
_raman_measurement_device.location 'IMMM Maine university'
_raman_measurement_device.company 'HORIBA Jobin Yvon'
_raman_measurement_device.model  T64000
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 100
_raman_measurement_device.microscope_numerical_aperture 0.90
_raman_measurement_device.excitation_laser_type Argon-Krypton
_raman_measurement_device.excitation_laser_wavelength 514
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 2
_raman_measurement_device.power_on_sample 2
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 0.8
_raman_measurement_device.diffraction_grating 600
_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 600
_raman_measurement.range_min     81.4356
_raman_measurement.range_max     2250.63
_rod_data_source.file            Akaganeite.rod
_rod_data_source.block           7200001
_rod_database.code               1000014
loop_
_raman_complementary.id
_raman_complementary.method
1 EDX
loop_
_raman_measurement_device_calibration.id
_raman_measurement_device_calibration.standard
1 Silicon_wafer
2 Diamond
loop_
_rod_related_entry.id
_rod_related_entry.code
_rod_related_entry.database
_rod_related_entry.uri
_rod_related_entry.description
1 9001319 COD http://www.crystallography.net/cod/9001319.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
81.4356 528
86.2491 474.5
91.058 527
95.8667 571
100.671 610
105.475 667
110.274 745
115.071 798
119.868 871
124.66 796
129.45 763
134.237 847.5
139.022 939
143.805 959.5
148.585 861
153.363 778.5
158.138 769.5
162.911 737
167.68 723
172.448 708
177.215 709
181.978 712.5
186.737 701.5
191.496 702
196.251 692
201.005 690
205.755 692
210.502 711.5
215.249 689
219.992 693
224.732 689
229.471 710.5
234.206 720
238.939 795.5
243.67 825.5
248.399 876
253.125 925
257.849 966
262.571 1020
267.288 1064
272.005 1107.5
276.72 1243
281.43 1394
286.14 1695
290.846 2065
295.549 2329.5
300.252 2483.5
304.951 2565.5
309.647 2543
314.343 2471
319.035 2317
323.724 2244
328.411 2156
333.096 2003
337.779 1837.5
342.459 1729
347.137 1650
351.81 1550
356.483 1540.5
361.154 1554
365.821 1570.5
370.487 1706.5
375.149 1800.5
379.811 1870
384.469 2061
389.126 2121
393.779 2075
398.429 1949.5
403.078 1925.5
407.724 1803
412.37 1777.5
417.011 1730
421.65 1638.5
426.285 1544.5
430.92 1502.5
435.552 1391
440.182 1361.5
444.81 1312
449.434 1252
454.057 1239
458.678 1197.5
463.295 1207
467.91 1190
472.524 1225
477.134 1223
481.744 1274
486.35 1318.5
490.953 1333
495.554 1325
500.153 1317
504.749 1308
509.344 1299
513.936 1298
518.526 1319.5
523.113 1365
527.699 1399.5
532.28 1431
536.861 1424
541.439 1386
546.014 1286
550.588 1210.5
555.158 1086
559.728 1049
564.294 1013.5
568.857 944
573.42 964
577.979 940
582.536 973.5
587.09 1010.5
591.643 1060
596.193 1167
600.741 1246
605.286 1332
609.83 1299
614.371 1299
618.908 1254
623.445 1201
627.98 1237.5
632.51 1226.5
637.041 1235.5
641.567 1273.5
646.09 1274.5
650.614 1323.5
655.134 1435
659.651 1505
664.166 1584.5
668.681 1666
673.192 1736
677.701 1756
682.207 1825
686.71 1857
691.212 1949.5
695.712 2058
700.21 2188
704.703 2332.5
709.197 2535
713.686 2712.5
718.175 2812
722.66 2789
727.145 2553
731.626 2260.5
736.104 1952.5
740.583 1681.5
745.057 1513.5
749.529 1328
753.999 1249.5
758.467 1209.5
762.932 1139.5
767.396 1081
771.855 1060.5
776.314 1028
780.771 1001.5
785.226 1013.5
789.677 977.5
794.128 962.5
798.574 952.5
803.021 942.5
807.463 948
811.903 934
816.343 902
820.779 909.5
825.213 958.5
829.645 904
834.074 936.5
838.502 937
842.927 923.5
847.35 922
851.771 940.5
856.19 948
860.605 927.5
865.02 924
869.433 908
873.841 936
878.25 921
882.654 933
887.057 926
891.459 960
895.857 984
900.253 988
904.647 1026
909.041 1068.5
913.43 1033.5
917.818 1018.5
922.202 1013
926.585 991.5
930.967 948.5
935.346 913
939.723 858
944.096 895.5
948.47 863
952.839 865
957.208 856
961.572 849.5
965.937 835
970.298 848
974.657 849.5
979.013 831
983.368 818
987.723 845
992.073 848.5
996.419 823
1000.77 827
1005.11 835
1009.45 815.5
1013.79 811.5
1018.13 821
1022.46 830
1026.8 847.5
1031.13 841
1035.46 846.5
1039.78 851
1044.11 822
1048.43 842.5
1052.75 843.5
1057.07 863.5
1061.38 851.5
1065.7 841
1070.01 854
1074.32 856
1078.63 869
1082.93 862
1087.23 844
1091.54 874
1095.84 882
1100.13 903.5
1104.43 889
1108.72 892.5
1113.01 905
1117.3 953.5
1121.58 918.5
1125.87 958
1130.15 954
1134.43 949
1138.7 978
1142.98 1004
1147.25 988.5
1151.52 1006
1155.79 974
1160.06 992.5
1164.33 967
1168.59 1018
1172.85 958
1177.11 979.5
1181.36 940
1185.62 918
1189.87 922
1194.12 898.5
1198.37 885
1202.61 870
1206.86 896
1211.1 863.5
1215.34 873
1219.58 872.5
1223.81 866
1228.05 846
1232.28 863.5
1236.5 869.5
1240.73 863
1244.96 882.5
1249.18 851.5
1253.4 879
1257.62 886
1261.84 883
1266.05 904.5
1270.26 929.5
1274.48 922
1278.68 966.5
1282.89 946
1287.09 967
1291.29 1010
1295.49 1029.5
1299.69 1014
1303.89 1058
1308.08 1066
1312.28 1050
1316.46 1091.5
1320.65 1058
1324.84 1105
1329.02 1097
1333.2 1132
1337.38 1135
1341.56 1155
1345.73 1158
1349.91 1136
1354.08 1157.5
1358.25 1169
1362.41 1194
1366.58 1190.5
1370.74 1221
1374.9 1205
1379.06 1187.5
1383.22 1208.5
1387.38 1221
1391.53 1195
1395.68 1221
1399.83 1252
1403.97 1214
1408.12 1236
1412.26 1215.5
1416.4 1233
1420.54 1203
1424.68 1198
1428.81 1190
1432.94 1169
1437.07 1141
1441.2 1120
1445.33 1113
1449.46 1093.5
1453.58 1084
1457.7 1021.5
1461.82 999
1465.93 977
1470.05 955.5
1474.16 940.5
1478.27 924
1482.38 914.5
1486.49 868.5
1490.59 872.5
1494.69 891
1498.79 877
1502.89 845.5
1506.99 846.5
1511.08 833.5
1515.18 837.5
1519.26 816
1523.35 807
1527.44 821.5
1531.52 817
1535.61 818.5
1539.69 801
1543.77 797
1547.84 770
1551.92 824
1555.99 780
1560.06 799.5
1564.13 791
1568.2 804
1572.26 761
1576.32 756.5
1580.38 756.5
1584.44 769
1588.5 772.5
1592.56 766
1596.61 752
1600.66 746.5
1604.71 732
1608.75 724.5
1612.8 737.5
1616.84 733.5
1620.88 717
1624.92 728.5
1628.96 717
1633 699
1637.03 694
1641.06 731
1645.09 695
1649.12 680
1653.14 697
1657.17 677
1661.19 702
1665.21 681.5
1669.22 681
1673.24 677
1677.25 682.5
1681.27 656
1685.28 669
1689.29 675
1693.29 653.5
1697.3 678
1701.3 669
1705.3 665
1709.3 666
1713.29 676
1717.29 649
1721.28 645
1725.27 651
1729.26 631
1733.25 644.5
1737.23 645
1741.21 653.5
1745.2 653.5
1749.18 634
1753.15 638.5
1757.13 629
1761.1 620.5
1765.07 650
1769.04 633
1773.01 623.5
1776.97 621.5
1780.94 616
1784.9 619
1788.86 628
1792.82 623
1796.78 621.5
1800.73 617.5
1804.68 619
1808.63 611
1812.58 605
1816.53 610
1820.47 590.5
1824.42 558
1828.36 597.5
1832.3 602
1836.24 594.5
1840.17 613.5
1844.1 613
1848.04 602.5
1851.96 590
1855.89 579
1859.82 591
1863.74 586.5
1867.67 612.5
1871.59 594
1875.5 597.5
1879.42 600.5
1883.34 564.5
1887.25 578.5
1891.16 582.5
1895.07 598
1898.98 576
1902.88 560.5
1906.79 569
1910.69 549.5
1914.59 573
1918.48 564
1922.38 591.5
1926.28 569.5
1930.17 555
1934.06 572
1937.95 581
1941.84 553
1945.72 602.5
1949.6 572
1953.48 557
1957.36 579.5
1961.24 580
1965.12 575.5
1968.99 575.5
1972.86 585
1976.73 564
1980.6 572
1984.47 560
1988.33 564
1992.2 582
1996.06 575.5
1999.92 567
2003.77 561
2007.63 586
2011.48 561.5
2015.33 542
2019.19 593
2023.03 580
2026.88 566.5
2030.72 557.5
2034.57 593.5
2038.41 601
2042.25 575
2046.08 569.5
2049.92 568
2053.75 583.5
2057.59 555.5
2061.42 550
2065.24 569
2069.07 568.5
2072.89 583
2076.72 584.5
2080.54 547
2084.36 582.5
2088.17 586
2091.99 549.5
2095.8 568.5
2099.62 564.5
2103.43 572.5
2107.23 584.5
2111.04 555
2114.85 566.5
2118.65 568
2122.45 565.5
2126.25 548.5
2130.05 566
2133.84 562
2137.64 557
2141.43 567
2145.22 557.5
2149.01 542
2152.79 558
2156.58 540
2160.36 555
2164.14 562
2167.92 568
2171.7 543
2175.48 561
2179.25 554.5
2183.03 534
2186.8 552
2190.57 543
2194.33 548
2198.1 552.5
2201.86 564.5
2205.62 531
2209.38 562
2213.14 535.5
2216.9 567
2220.65 530.5
2224.41 552.5
2228.16 546
2231.91 548.5
2235.66 576.5
2239.4 562
2243.15 537
2246.89 518
2250.63 558