#------------------------------------------------------------------------------
#$Date: 2018-02-06 16:25:16 +0200 (Tue, 06 Feb 2018) $
#$Revision: 427 $
#$URL: svn://172.16.1.111/rod/cif/3/50/02/3500211.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_3500211
loop_
_publ_author_name
'El Mendili, Y'
'Secchi, M'
'Zannatta, M'
_publ_section_title
;
 Raman spectrum of commercial Rutile
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2018
_chemical_compound_source        'commercial powder Prolabo pur'
_chemical_formula_structural     'O2 Ti'
_chemical_formula_sum            'O2 Ti'
_chemical_name_mineral           Rutile
_chemical_name_systematic        'titanium(IV) oxide'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   4.6107
_cell_length_b                   4.6107
_cell_length_c                   2.9732
_raman_determination_method      experimental
_[local]_chemical_compound_color white
_[local]_chemical_compound_state Solid
_raman_measurement_device.location 'University of Trento'
_raman_measurement_device.company Horiba
_raman_measurement_device.model  Aramis
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 50
_raman_measurement_device.microscope_numerical_aperture 0.90
_raman_measurement_device.excitation_laser_type helium-neon
_raman_measurement_device.excitation_laser_wavelength 633
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 2
_raman_measurement_device.power_on_sample 12
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1
_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 5
_raman_measurement.datetime_initiated 2018-01-15
_rod_data_source.file            TiO2Rutile.rod
_rod_data_source.block           3500020
_rod_database.code               3500211
loop_
_raman_complementary.id
_raman_complementary.method
1 EDX
loop_
_raman_measurement_device_calibration.id
_raman_measurement_device_calibration.standard
1 silicon_wafer
loop_
_rod_related_entry.id
_rod_related_entry.code
_rod_related_entry.database
_rod_related_entry.uri
_rod_related_entry.description
1 1534781 COD http://www.crystallography.net/cod/1534781.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
102.279 5516
104.522 5679.5
106.766 5855.75
109.007 5898.25
111.248 5980.75
113.489 6036.25
115.728 6171.5
117.967 6183
120.207 6279
122.445 6376.5
124.682 6472
126.919 6533.75
129.155 6637.25
131.39 6730
133.624 6870
135.858 7088.75
138.09 7460.25
140.323 8332
142.555 9461
144.786 9563.75
147.017 8897.5
149.247 8101.5
151.475 7727.25
153.704 7580.5
155.932 7555
158.158 7596.5
160.385 7631
162.612 7767.75
164.836 7889.25
167.061 8016.75
169.284 8273.5
171.508 8470
173.729 8834
175.952 9233.5
178.172 9448.5
180.394 9903.25
182.613 10295
184.833 10594.5
187.051 11090.8
189.268 11394.8
191.486 11827
193.702 12163.3
195.917 12627.3
198.134 13072
200.348 13513.3
202.561 13907.3
204.774 14234.3
206.986 14599.3
209.198 14975.3
211.409 15232.8
213.621 15590.5
215.83 15964.8
218.039 16208.3
220.248 16449.3
222.456 16761.5
224.663 16882.5
226.868 17030.3
229.074 17266.5
231.279 17484.5
233.484 17473
235.688 17637.3
237.892 17741.5
240.093 17671
242.295 17471.5
244.497 17403
246.698 17056
248.897 16912.3
251.096 16448
253.295 16077.3
255.492 15777.5
257.69 15375
259.886 15146
262.083 14854
264.277 14684.8
266.473 14394
268.666 14232.8
270.86 13879
273.052 13741.3
275.245 13459.8
277.436 13262.5
279.626 13030
281.816 12680.3
284.006 12414.5
286.194 11999.5
288.382 11690.8
290.569 11508
292.757 11182.5
294.943 10958.5
297.128 10758.5
299.313 10636.5
301.497 10477.3
303.68 10445
305.863 10418
308.045 10488.3
310.227 10517.8
312.408 10611
314.588 10732
316.768 10938.5
318.947 10969.3
321.125 10998.5
323.302 11135.8
325.479 11331.3
327.656 11282.5
329.832 11318
332.007 11333.5
334.181 11396.5
336.355 11516
338.528 11534.5
340.7 11643
342.872 11755.3
345.043 11877
347.214 12013
349.383 12116.3
351.553 12234.8
353.721 12465
355.889 12599.8
358.056 12686.5
360.224 12805.8
362.389 12864
364.554 12846.3
366.72 12844.3
368.883 13022.8
371.046 13042.5
373.209 13109.5
375.372 13150.3
377.533 13234
379.694 13394
381.854 13536
384.013 13588.5
386.172 13724.8
388.33 13863.3
390.487 14087.8
392.644 14339
394.801 14672.5
396.957 14897.8
399.112 15318.5
401.266 15677
403.42 16252.5
405.574 16923
407.726 17720.5
409.878 18240.5
412.029 19159
414.179 20262.3
416.33 21361.5
418.48 22705
420.627 23948.8
422.776 25452.8
424.922 27242.5
427.07 29031.8
429.216 30891.3
431.361 32872.8
433.507 34575.8
435.65 36556.5
437.794 38608
439.937 40543.5
442.078 42388.3
444.221 43827.5
446.361 44634
448.503 45201
450.642 44740
452.781 43595
454.919 41645
457.058 39207.3
459.195 36370.3
461.331 33361.8
463.467 30057
465.602 27325.3
467.737 24631.8
469.871 22353
472.004 20282
474.137 18623
476.269 17197.3
478.401 15953
480.532 14862.5
482.662 13975.3
484.792 13244
486.921 12555.8
489.05 12100.8
491.178 11684
493.304 11226.5
495.431 10950
497.557 10741.3
499.682 10493.5
501.806 10422.8
503.931 10210.5
506.054 10143.5
508.176 10101.5
510.299 10070
512.42 10089.5
514.541 10051.5
516.661 10012.8
518.781 10078.3
520.9 10002.3
523.019 9974.5
525.136 10022.5
527.253 10050.3
529.37 10085
531.485 10104.3
533.6 10104.5
535.714 10080
537.83 10170.8
539.943 10230.8
542.055 10307
544.167 10460.8
546.278 10617.8
548.389 10760
550.499 10974.5
552.609 11076.3
554.718 11452
556.826 11782.5
558.934 12161.8
561.041 12562.3
563.148 12953.3
565.254 13447
567.359 14012.3
569.464 14596
571.569 15217
573.671 15955.5
575.774 16780.3
577.877 17673
579.977 18690
582.079 19755
584.18 20813.8
586.279 22005.8
588.378 23394.5
590.476 24819.8
592.574 26247.8
594.671 27913.5
596.768 29913
598.864 31764.5
600.96 33579
603.054 35576.8
605.148 37362
607.242 38611
609.335 39423.8
611.427 39847
613.519 39750.3
615.61 39008.5
617.7 37416.8
619.79 35920.8
621.879 33846
623.968 31437.8
626.055 29371
628.144 27148.3
630.231 25135
632.317 23224.5
634.403 21444
636.486 19787.8
638.571 18419.3
640.655 17375.8
642.738 16170
644.821 15394.3
646.903 14424.5
648.984 13665.3
651.064 12981
653.144 12426
655.224 11886.5
657.302 11406.8
659.381 10982
661.459 10595.8
663.535 10292.5
665.612 10050.3
667.687 9675.75
669.763 9506.75
671.837 9285.5
673.912 9022.25
675.985 8733.75
678.058 8558.25
680.13 8367.25
682.201 8125.25
684.273 7957.5
686.343 7832.5
688.412 7668.25
690.481 7474
692.551 7281.25
694.618 7119.5
696.686 7003.5
698.752 6844
700.818 6682
702.883 6552.25
704.948 6382.5
707.013 6180
709.076 6077.5
711.139 5927.25
713.202 5794.5
715.264 5657
717.326 5506.75
719.385 5365
721.445 5171.25
723.505 5066
725.564 4900.75
727.623 4736.5
729.68 4599.25
731.737 4494.75
733.794 4405
735.849 4226.75
737.905 4130.75
739.959 3983
742.014 3897
744.067 3820.5
746.12 3705
748.172 3614.25
750.224 3524
752.275 3476.25
754.325 3381
756.376 3297.5
758.424 3234.75
760.473 3172.25
762.521 3102.5
764.569 3010.75
766.616 2966
768.662 2961
770.707 2900.25
772.752 2843
774.797 2799.75
776.841 2758.75
778.884 2725.25
780.927 2661.5
782.969 2621.5
785.01 2618.5
787.051 2552.75
789.092 2518.75
791.132 2479
793.171 2437.25
795.209 2453.25
797.247 2393.5
799.285 2374.5
801.322 2367.5
803.357 2333.25
805.393 2310
807.428 2261.25
809.463 2220.5
811.497 2270.75
813.529 2235.25
815.563 2212.25
817.594 2184
819.625 2176.25
821.657 2143
823.687 2135
825.717 2115.25
827.746 2143.75
829.774 2134.5
831.801 2053.75
833.83 2064.25
835.856 2029.75
837.882 1980
839.908 1915.25
841.932 1901
843.957 1898
845.982 1846
848.005 1847.75
850.027 1824.5
852.05 1788.75
854.07 1756.5
856.091 1737
858.111 1682.5
860.131 1656
862.15 1637
864.169 1630.75
866.187 1592.25
868.204 1583.25
870.221 1568.5
872.238 1547.5
874.252 1534.75
876.268 1526
878.283 1507.75
880.296 1459.5
882.31 1474.75
884.322 1451.75
886.335 1431.75
888.345 1406.75
890.356 1404
892.367 1413.25
894.376 1380.5
896.386 1370
898.395 1370.5
900.402 1365.75
902.409 1341.75
904.417 1347
906.423 1314.75
908.429 1337.5
910.434 1316.5
912.438 1318.25
914.442 1303.25
916.445 1257
918.448 1266.25
920.451 1263.5
922.452 1229.25
924.453 1251.5
926.454 1224.25
928.454 1228.5
930.454 1219.25
932.451 1218.25
934.45 1203.5
936.448 1196.5
938.445 1177.75
940.441 1148.25
942.437 1165.5
944.433 1149
946.427 1133
948.422 1107.25
950.415 1101.5
952.408 1119.75
954.4 1088
956.393 1091.5
958.383 1088
960.374 1059
962.365 1068.25
964.354 1058
966.342 1023.75
968.332 1047
970.319 1037.5
972.306 1019.25
974.293 1007.5
976.279 1015.75
978.265 996.5
980.25 989.25
982.234 986.25
984.218 980
986.202 962.75
988.184 956
990.166 952.75
992.147 936.75
994.128 925.25
996.109 925
998.089 900.5
1000.07 916
1002.05 903.5
1004.02 889
1006 875.25
1007.98 867.5
1009.96 873.5
1011.93 857.5
1013.91 855.25
1015.88 866.25
1017.86 829.25
1019.83 825.5
1021.8 834.25
1023.77 820.75
1025.75 818.25
1027.72 782
1029.69 784.5
1031.66 772.25
1033.63 783
1035.6 790
1037.57 771.5
1039.53 768.25
1041.5 743.25
1043.47 753.75
1045.43 740.25
1047.4 729.75
1049.36 723.25
1051.33 733.25
1053.29 733
1055.26 700
1057.22 729.5
1059.18 689
1061.14 681.25
1063.11 696.75
1065.06 670.5
1067.03 672.75
1068.98 658.5
1070.94 651.5
1072.9 650.5
1074.86 654
1076.82 647.5
1078.77 650.25
1080.73 642
1082.69 617.75
1084.64 629.75
1086.59 608.25
1088.55 621.5
1090.5 599.5
1092.45 597.25
1094.41 603.5
1096.36 583.5
1098.31 589.25
1100.26 572
1102.21 570.5
1104.16 585.75
1106.11 566
1108.06 578
1110 577.25
1111.95 558.25
1113.9 569
1115.84 560.5
1117.79 564.75
1119.73 562.25
1121.68 560.75
1123.62 557.5
1125.57 557.25
1127.51 543.25
1129.45 543.25
1131.39 549.25
1133.33 549.75
1135.27 527
1137.21 527.5
1139.15 550
1141.09 545.5
1143.03 525.25
1144.97 537.75
1146.9 527
1148.84 514
1150.78 535
1152.71 541.5
1154.65 534.25
1156.58 539
1158.52 512.5
1160.45 521.25
1162.38 524
1164.31 518.5
1166.25 521
1168.18 520.75
1170.11 499.75
1172.04 496.75
1173.97 500.5
1175.9 508.5
1177.83 515.25
1179.75 504.25
1181.68 497.25
1183.61 494.5
1185.53 496.75
1187.46 492.5
1189.38 507.25
1191.31 503.5
1193.23 481.25
1195.16 497
1197.08 498
1199 483.5
1200.92 484.5
1202.84 490.5
1204.76 470.25
1206.68 466.25
1208.6 469.5
1210.52 468
1212.44 475.5
1214.36 487.5
1216.28 463
1218.19 477.75
1220.11 468
1222.03 466.5
1223.94 476
1225.86 451.75
1227.77 473.25
1229.68 450.75
1231.6 453.25
1233.51 447.25
1235.42 455.25
1237.33 457.5
1239.24 452
1241.15 449.25
1243.06 452
1244.97 451.5
1246.88 446
1248.79 437.25
1250.7 465
1252.6 430.5
1254.51 448
1256.42 432
1258.32 444.5
1260.23 439.5
1262.13 435.25
1264.04 448.75
1265.94 432.75
1267.84 423.5
1269.74 437.5
1271.64 418.25
1273.55 427.25
1275.45 409.75
1277.35 414.25
1279.25 416.75
1281.14 417.25
1283.04 426.5
1284.94 412.5
1286.84 410
1288.74 403.75
1290.63 405.25
1292.53 404.75
1294.42 395.25
1296.32 390.25
1298.21 406.25
1300.11 400.25
1302 392.5
1303.89 381.5
1305.78 388.75
1307.67 381
1309.57 381.75
1311.46 381
1313.34 374
1315.23 373.5
1317.12 390.25
1319.01 385.5
1320.9 369.25
1322.79 380.75
1324.67 368.75
1326.56 380.5
1328.45 366
1330.33 368
1332.21 353.25
1334.1 396.75
1335.98 369
1337.86 363.5
1339.75 363.75
1341.63 366.25
1343.51 365.25
1345.39 359
1347.27 369.5
1349.15 368.25
1351.03 372
1352.91 374
1354.79 354
1356.66 366.5
1358.54 362
1360.42 358
1362.29 367.5
1364.17 361.75
1366.04 356
1367.92 368.5
1369.79 359.5
1371.67 362.25
1373.54 372.5
1375.41 360.25
1377.28 356
1379.15 366.25
1381.03 352.75
1382.9 341.75
1384.76 354.75
1386.63 360
1388.5 363.75
1390.37 369.5
1392.24 358
1394.11 361.5
1395.97 366.25
1397.84 363.75
1399.7 359.5
1401.57 352.5
1403.43 356.5
1405.3 354.25
1407.16 352.75
1409.02 351
1410.89 356.75
1412.75 353
1414.61 347.25
1416.47 355.25
1418.33 351.25
1420.19 357.5
1422.05 364.25
1423.91 352.25
1425.77 352.25
1427.62 369.75
1429.48 354
1431.34 354
1433.19 352
1435.05 359.25
1436.9 361.5
1438.76 369.75
1440.61 365
1442.47 372
1444.32 359.75
1446.17 364.75
1448.02 352
1449.87 367
1451.73 354.75
1453.58 358.5
1455.42 362.75
1457.27 363
1459.12 369.75
1460.97 377.75
1462.82 363
1464.67 369.25
1466.51 378.25
1468.36 372
1470.2 364.25
1472.05 373.5
1473.89 377.5
1475.74 380
1477.58 366.5
1479.42 376
1481.27 365.25
1483.11 380
1484.95 379.25
1486.79 386.25
1488.63 372
1490.47 389.75
1492.31 372
1494.15 366.5
1495.99 394
1497.83 397
1499.66 382.25
1501.5 392
1503.34 391.75
1505.17 398.5
1507.01 386
1508.84 400.75
1510.68 395.25
1512.51 405.5
1514.35 405.5
1516.18 410
1518.01 392.25
1519.84 408.75
1521.67 400
1523.5 416.5
1525.33 403
1527.16 415.5
1528.99 404
1530.82 424.5
1532.65 405.75
1534.48 422.25
1536.3 433.5
1538.13 413.5
1539.96 420.5
1541.78 422.25
1543.61 421.75
1545.43 426.75
1547.26 431.5
1549.08 419.25
1550.9 435
1552.73 416.25
1554.55 445.5
1556.37 438.25
1558.19 445.75
1560.01 449.25
1561.83 448
1563.65 435
1565.47 437.25
1567.29 438.25
1569.11 436.5
1570.92 450
1572.74 447.5
1574.56 448.75
1576.37 467
1578.19 445.25
1580 463.25
1581.82 445
1583.63 448
1585.45 466.5
1587.26 474
1589.07 457.5
1590.88 472
1592.69 461.75
1594.51 461
1596.32 457
1598.13 476.5
1599.94 476.75
1601.74 467.75
1603.55 459
1605.36 467.25
1607.17 463.5
1608.97 470
1610.78 444.25
1612.59 461.75
1614.39 453.5
1616.2 466
1618 450.5
1619.81 463
1621.61 457.25
1623.41 447.75
1625.21 455.5
1627.02 447.75
1628.82 442
1630.62 432.5
1632.42 453
1634.22 456.5
1636.02 429.25
1637.82 435.25
1639.61 430.25
1641.41 420.25
1643.21 429.75
1645.01 422.25
1646.8 430.25
1648.6 403.75
1650.39 420
1652.19 422
1653.98 395
1655.78 393.25
1657.57 402
1659.36 387.75
1661.16 370.75
1662.95 369.5
1664.74 372.75
1666.53 361.5
1668.32 368.25
1670.11 354.25
1671.9 351.5
1673.69 347.25
1675.48 343.5
1677.26 342
1679.05 331
1680.84 332.5
1682.63 327.5
1684.41 313.25
1686.2 310
1687.98 309
1689.77 306.75
1691.55 309.5
1693.33 300.5
1695.12 305
1696.9 293.75
1698.68 301
1700.46 280
1702.24 290.25
1704.02 288.5
1705.8 283
1707.58 289.5
1709.36 271.5
1711.14 292
1712.92 281.5
1714.7 272.25
1716.47 257.5
1718.25 277.5
1720.03 267.25
1721.8 278.75
1723.58 265.5
1725.35 258
1727.13 252
1728.9 255.5
1730.67 270.5
1732.44 257
1734.22 257.5
1735.99 251.75
1737.76 248
1739.53 242.75
1741.3 236.75
1743.07 236.75
1744.84 258.75
1746.61 241.75
1748.38 238.5
1750.14 237
1751.91 251
1753.68 233
1755.44 232.25
1757.21 246.75
1758.98 225.5
1760.74 246.5
1762.5 232.5
1764.27 230
1766.03 236
1767.79 224
1769.56 231.5
1771.32 228
1773.08 226.75
1774.84 236.25
1776.6 221
1778.36 230.75
1780.12 222
1781.88 226.75
1783.64 224.5
1785.4 223.75
1787.15 223.75
1788.91 225.5
1790.67 216.25
1792.42 231.75
1794.18 233
1795.93 221
1797.69 227
1799.44 226.25
1801.2 223.25
1802.95 229
1804.7 221.5
1806.46 224.5
1808.21 219.5
1809.96 212.25
1811.71 225
1813.46 220.5
1815.21 210.25
1816.96 210.75
1818.71 217.25
1820.46 207.5
1822.2 214.25
1823.95 221.5
1825.7 222
1827.44 217
1829.19 217
1830.94 212
1832.68 218.5
1834.42 229.75
1836.17 220.5
1837.91 212.5
1839.66 216.75
1841.4 214.5
1843.14 206.75
1844.88 219
1846.62 209.75
1848.36 205
1850.1 218
1851.84 216.75
1853.58 216.5
1855.32 210
1857.06 202
1858.8 219
1860.54 198.75
1862.27 200.5
1864.01 216
1865.74 202.5
1867.48 213.25
1869.22 210.5
1870.95 215.75
1872.68 216.25
1874.42 203.5
1876.15 201.5
1877.88 215
1879.61 207
1881.35 215.5
1883.08 207.5
1884.81 211.25
1886.54 204.5
1888.27 214
1890 207.25
1891.73 215
1893.45 209.25
1895.18 211.5
1896.91 203.75
1898.64 206.75
1900.36 209.25
1902.09 211.25
1903.81 217
1905.54 204.25
1907.26 202.25
1908.99 203.25
1910.71 212.5
1912.43 200.5
1914.16 208.5
1915.88 201.75
1917.6 210.75
1919.32 205
1921.04 210.5
1922.76 214.25
1924.48 198.5
1926.2 212
1927.92 214.75
1929.64 213.5
1931.36 199.25
1933.08 205.25
1934.79 213.75
1936.51 206.25
1938.23 209.75
1939.94 214.25
1941.66 207
1943.37 208.25
1945.08 210.5
1946.8 203.25
1948.51 194
1950.22 209.25
1951.94 205.25
1953.65 201.5
1955.36 208
1957.07 213.75
1958.78 207
1960.49 199.25
1962.2 203
1963.91 212.75
1965.62 208.5
1967.33 202.25
1969.03 206.75
1970.74 197
1972.45 213.5
1974.15 207
1975.86 203.25
1977.56 211.25
1979.27 210
1980.97 209.75
1982.68 206
1984.38 206.75
1986.08 196.5
1987.79 205.5
1989.49 218
1991.19 199.5
1992.89 196
1994.59 207.75
1996.29 205.75
1997.99 213
1999.69 215