#------------------------------------------------------------------------------
#$Date: 2018-09-06 15:09:45 +0300 (Thu, 06 Sep 2018) $
#$Revision: 1325 $
#$URL: svn://172.16.1.111/rod/cif/3/50/02/3500262.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_3500262
loop_
_publ_author_name
'Kumar, A.'
'Cassetta, M.'
'El Mendili, Y.'
'Zanatta, M.'
'Daldosso, N.'
'Mariotto, G.'
_publ_section_title
;
 Raman spectrum of commercial TiO2 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 Verona'
_raman_measurement_device.company Horiba
_raman_measurement_device.model  LabRamHR800
_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 0.50
_raman_measurement_device.excitation_laser_type helium-neon
_raman_measurement_device.excitation_laser_wavelength 633
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 1
_raman_measurement_device.power_on_sample 6
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1.5
_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 2018-01-22
_rod_data_source.file            TiO2Rutile.txt
_rod_data_source.block           0000001
_rod_database.code               3500262
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
150.04601 4898.7998
151.323 4892.7998
152.59801 4837.6001
153.87399 4911.7998
155.151 4852
156.425 4895.7998
157.701 4893.6001
158.97701 4983.3999
160.25101 5015.6001
161.526 5090.2002
162.80099 5142
164.075 5216.6001
165.349 5296.6001
166.62399 5344.2002
167.896 5442
169.17101 5517.2002
170.44299 5627
171.716 5727.2002
172.98801 5871
174.26199 5966.2002
175.535 6153.3999
176.806 6212.6001
178.078 6323.7998
179.349 6448.3999
180.621 6680.2002
181.892 6733.6001
183.164 6914
184.43401 7089.3999
185.705 7235.7998
186.97501 7383.2002
188.246 7593.2002
189.515 7633.7998
190.785 7802.3999
192.054 7935.6001
193.32401 8121.6001
194.593 8344.4004
195.862 8429.5996
197.13 8710.2002
198.39799 8798
199.66701 8926.5996
200.93401 9115
202.203 9321.7998
203.47 9460.5996
204.737 9664.7998
206.005 9845.7998
207.271 9993.7998
208.539 10086.4
209.80499 10233.8
211.07001 10424.2
212.33701 10611.2
213.603 10739.6
214.868 10875.4
216.134 11029.2
217.399 11077.6
218.66299 11299.8
219.929 11369
221.19299 11410.2
222.457 11696.8
223.72099 11673.4
224.98599 11781.2
226.24899 11946.4
227.51199 12046.6
228.776 12133
230.039 12234.6
231.30099 12187.6
232.564 12219.6
233.827 12306
235.089 12281.8
236.351 12296.6
237.612 12284.4
238.873 12279.2
240.136 12320.6
241.397 12293.4
242.657 12268.4
243.918 12076.4
245.17799 12033.8
246.438 11902.6
247.698 11737.2
248.959 11627.2
250.218 11509.8
251.47701 11208.2
252.73599 11085.8
253.995 11004
255.25301 10861.2
256.51199 10700.8
257.76999 10589.8
259.02802 10397.8
260.28699 10316.4
261.54501 10124.4
262.802 10098.2
264.05899 10044.6
265.31601 9827.4004
266.573 9855.4004
267.82901 9799
269.086 9654
270.34201 9571.7998
271.59799 9462.4004
272.853 9434
274.10901 9421.5996
275.36401 9315
276.61899 9219.4004
277.87399 9070.2002
279.129 9042.5996
280.383 8927.4004
281.638 8828.4004
282.89001 8758.2002
284.14401 8567.7998
285.39801 8500
286.651 8402
287.905 8291.7998
289.15799 8155.3999
290.41 8080
291.66299 7973.3999
292.91599 7874.7998
294.168 7832.3999
295.418 7739.3999
296.67001 7628.2002
297.922 7605.2002
299.173 7491.7998
300.42499 7550
301.67599 7532.2002
302.92499 7502.2002
304.17599 7468.3999
305.42599 7487.3999
306.677 7606.7998
307.927 7615.3999
309.17499 7637.2002
310.42499 7602.3999
311.67401 7750.7998
312.923 7728.2002
314.17099 7888
315.42001 7954
316.668 7992.3999
317.91699 8014.7998
319.16299 7980.2002
320.41101 8068.7998
321.659 8083.3999
322.905 8170.3999
324.15302 8184
325.39999 8235
326.647 8204.4004
327.89301 8235.2002
329.13901 8228
330.384 8278
331.63 8214
332.87601 8289.4004
334.121 8362
335.366 8305.7998
336.612 8345.4004
337.85599 8321.2002
339.10101 8445.7998
340.34399 8448.5996
341.58899 8508.5996
342.83301 8524.2002
344.07599 8631.5996
345.32001 8537.5996
346.56201 8593.5996
347.806 8697.5996
349.048 8802.2002
350.29099 8829.4004
351.53201 8912
352.77499 8945
354.01599 9017.7998
355.259 9055.5996
356.5 9051.2002
357.742 9091.2002
358.98199 9155.2002
360.224 9229.4004
361.46399 9227
362.70499 9281
363.944 9278
365.185 9262.5996
366.42401 9326.4004
367.66299 9292
368.90399 9326.2002
370.142 9371
371.38199 9377.7998
372.62 9434.5996
373.858 9407.4004
375.09698 9481.2002
376.33499 9485
377.57401 9577.4004
378.811 9672.7998
380.048 9632.5996
381.28601 9702.2002
382.52301 9749.4004
383.759 9736.5996
384.99701 9839
386.233 9876
387.46799 9938.2002
388.70401 10066
389.94101 10092
391.17599 10294.6
392.41101 10389.4
393.647 10460.8
394.88199 10571
396.116 10716.6
397.35101 10804
398.58499 10971.8
399.82001 11133
401.05301 11409.4
402.28699 11633
403.51999 11907.8
404.755 12156.4
405.987 12461.6
407.22 12664.6
408.452 13041
409.685 13476.6
410.91699 13837
412.14899 14181.8
413.38199 14618
414.61301 15062.2
415.84399 15536.2
417.07501 16148.8
418.306 16649.6
419.53699 17212.6
420.767 17813.6
421.99799 18513.199
423.228 19206.801
424.45901 19963.199
425.689 20719
426.918 21569.199
428.147 22305.6
429.37601 23250.801
430.60501 24001.6
431.83401 24678
433.06299 25599.4
434.29099 26512.199
435.51901 27383.199
436.74701 28419.199
437.97501 29128.199
439.202 30018.4
440.42899 30809.6
441.65601 31432.801
442.883 32021.4
444.10999 32562.6
445.33499 32933.602
446.56201 33227.602
447.78799 33189.398
449.01401 33037
450.23901 32660.801
451.465 31966
452.69 31268
453.91501 30350.199
455.14001 29288.801
456.36499 28211.801
457.58801 26686.6
458.81299 25447
460.03699 24187
461.26099 22880.801
462.48499 21665.199
463.70801 20376.801
464.92999 19193.6
466.15302 18135.801
467.37601 17093.199
468.599 16135.4
469.82001 15359.8
471.043 14505.2
472.26501 13893.4
473.487 13169.4
474.70901 12482.4
475.92899 12010.2
477.151 11421.6
478.37201 11044.2
479.59201 10597
480.81201 10221.4
482.03299 9899.7998
483.254 9564.2002
484.47198 9281.2002
485.69299 9055
486.91199 8847.2002
488.13101 8648
489.35001 8527.4004
490.56799 8364
491.78699 8180.7998
493.00601 8083.3999
494.22299 7919.2002
495.44199 7861.7998
496.66 7733
497.87701 7680.2002
499.095 7650.6001
500.311 7533
501.52899 7451.2002
502.745 7433
503.96201 7364.7998
505.17899 7379.7998
506.39401 7285
507.61099 7390.6001
508.82599 7333.3999
510.04199 7365.7998
511.25699 7358.2002
512.47302 7300.7998
513.68701 7315.3999
514.90198 7333.6001
516.11603 7323
517.33099 7370
518.54498 7376.7998
519.75897 7328.2002
520.97198 7300.7998
522.185 7305.6001
523.39899 7300.3999
524.612 7299.7998
525.82501 7394.3999
527.03802 7382.7998
528.24902 7368.2002
529.46301 7341
530.67401 7341.7998
531.88702 7384
533.09802 7345
534.30902 7393
535.521 7432
536.73199 7449
537.94202 7509.3999
539.15399 7534.7998
540.36298 7593.6001
541.573 7606.2002
542.784 7615
543.99402 7702.6001
545.203 7725.2002
546.41199 7852.6001
547.62201 7913
548.83099 7937.3999
550.039 8066.6001
551.24701 8192
552.45697 8353.5996
553.66498 8413
554.87201 8530.2002
556.08002 8646.4004
557.289 8813.5996
558.49597 8986
559.703 9204.5996
560.909 9297.2002
562.11603 9540.2002
563.32202 9780.4004
564.53003 10013.8
565.73602 10311
566.94202 10512.4
568.14697 10722
569.35303 11027
570.55798 11347.8
571.763 11633.2
572.96802 12019
574.17401 12228.4
575.37799 12788.2
576.58197 13038.6
577.78601 13499.6
578.98999 13885.2
580.19397 14323
581.39697 14841.2
582.60101 15290.2
583.80402 15776.2
585.00702 16190.6
586.20898 16906.6
587.41199 17470.199
588.61401 18009.801
589.81598 18655.4
591.01801 19384.199
592.21997 20142.199
593.422 20789.4
594.62299 21684
595.82397 22382.801
597.02502 23169.199
598.22601 23924.6
599.427 24819
600.62598 25575
601.82599 26260.199
603.026 27041.4
604.22601 27762.4
605.42603 28436.199
606.625 28916.199
607.82397 29468
609.02301 29495
610.22101 29630.6
611.41998 29575.6
612.61798 29364.801
613.81702 28918.801
615.01501 28325
616.21301 27617
617.409 26916.6
618.60699 26027.4
619.80402 25151.4
621.00098 24129.199
622.19702 23184.6
623.39398 22097.199
624.591 21291.199
625.78699 20295.199
626.98199 19357.199
628.17798 18499.199
629.37402 17614.801
630.57001 16931.6
631.76398 16097.4
632.95898 15486.2
634.15399 14818.6
635.34802 14106.6
636.54199 13619.2
637.737 13009.4
638.92999 12512.4
640.12402 12117.6
641.31799 11580.2
642.51099 11154.6
643.70398 10870
644.896 10499.6
646.09003 10244
647.28302 9940
648.474 9593.7998
649.66699 9402.2002
650.85797 9117.5996
652.04999 8923.5996
653.24103 8748.4004
654.43298 8571.4004
655.62299 8374
656.815 8171.6001
658.00598 8043.3999
659.19598 7885.6001
660.38702 7780.2002
661.57703 7595.2002
662.76599 7488.2002
663.95599 7416.3999
665.14502 7316.6001
666.33502 7187.2002
667.52399 7079.3999
668.71399 6981.6001
669.90198 6904.3999
671.091 6775.6001
672.27899 6697.7998
673.466 6607
674.65503 6501
675.84198 6449.6001
677.03101 6342.6001
678.21802 6251.2002
679.40399 6194.3999
680.59198 6185.7998
681.77802 6126.6001
682.96399 6102.2002
684.15198 5934.3999
685.33698 5906.2002
686.52301 5859.2002
687.71002 5792.7998
688.89502 5737.7998
690.08002 5628.6001
691.26599 5615.6001
692.45001 5545.6001
693.63501 5387.6001
694.81897 5375.6001
696.00403 5352.2002
697.18799 5307.3999
698.37201 5172.3999
699.55499 5179.2002
700.73901 5057.7998
701.92297 5054.2002
703.10602 5018.2002
704.289 4898.3999
705.47101 4910.7998
706.65399 4856.2002
707.83698 4745.7998
709.01898 4649.7998
710.20099 4585
711.383 4528.6001
712.56403 4450.3999
713.745 4372.7998
714.927 4314.3999
716.10901 4275.7998
717.289 4175.3999
718.46997 4140
719.65002 4061.6001
720.83002 3996.3999
722.01001 3961.8
723.19 3844.6001
724.37 3818.6001
725.54901 3738.2
726.72803 3723.8
727.90698 3636.6001
729.086 3562.8
730.26501 3509.2
731.44299 3465.3999
732.62201 3395.6001
733.79999 3367.2
734.97803 3318.6001
736.15503 3244.6001
737.33301 3169.3999
738.51001 3152.2
739.68799 3080
740.86499 3068
742.04102 3006.8
743.21802 2947.6001
744.39502 2910.3999
745.56897 2874.6001
746.745 2825
747.92102 2771.8
749.09698 2764.6001
750.27301 2730
751.448 2684.8
752.62299 2630
753.797 2613.8
754.97198 2591.2
756.146 2529.6001
757.32098 2496
758.495 2477.3999
759.66803 2427.6001
760.841 2421.2
762.01501 2360.3999
763.18903 2398.8
764.362 2336.6001
765.534 2327.3999
766.70697 2246.2
767.88 2281.3999
769.05103 2228.8
770.22302 2197.2
771.39502 2167.6001
772.56799 2215.8
773.73798 2141
774.90997 2150.2
776.08099 2113
777.25098 2085.6001
778.422 2113.6001
779.59302 2047.4
780.763 2035.8
781.93298 2045.8
783.10199 1999.6
784.27301 1995.8
785.44299 2008.6
786.61102 1991.2
787.78101 2005.4
788.94897 1945.8
790.11798 1934.4
791.28699 1917.2
792.45502 1943.2
793.62402 1922.2
794.79102 1943.6
795.95898 1868
797.12598 1859
798.29401 1836.6
799.461 1841.2
800.62799 1890.6
801.79498 1826.2
802.96198 1803.8
804.12799 1795
805.29498 1797.8
806.46002 1812.8
807.62701 1833.6
808.79199 1773
809.95599 1788.2
811.12299 1731.6
812.28699 1776.8
813.453 1754.6
814.617 1724.2
815.78101 1718.6
816.94598 1747.6
818.10999 1729.4
819.27301 1721.8
820.43799 1715.6
821.60101 1716
822.763 1714
823.92798 1707.6
825.09003 1692.8
826.25201 1714.2
827.41602 1696.2
828.578 1658.2
829.73999 1676.4
830.901 1624
832.06403 1648.2
833.22498 1656.4
834.38599 1626
835.547 1622.4
836.70898 1589.4
837.87 1570.2
839.03003 1575.6
840.19 1568.6
841.34998 1552.6
842.51202 1552.8
843.67102 1523.4
844.83099 1496.8
845.98999 1500
847.14899 1490
848.30798 1466.6
849.46802 1451.6
850.62701 1436.2
851.78497 1416.4
852.94299 1423
854.10101 1405.2
855.25897 1386.6
856.41699 1388.6
857.57397 1392.8
858.73102 1375.4
859.888 1374.8
861.04498 1352.2
862.20203 1348.8
863.35901 1331.6
864.51501 1320.2
865.67102 1301
866.82703 1298.2
867.98297 1301.8
869.13898 1293.2
870.29401 1284.6
871.45001 1288
872.60498 1259.6
873.76001 1249.8
874.91498 1237.6
876.06897 1218.4
877.224 1214.8
878.37799 1193.6
879.53198 1222.4
880.68597 1219
881.84003 1227.4
882.992 1178
884.14502 1169.6
885.29797 1174.6
886.45099 1197.6
887.604 1164.6
888.75702 1160
889.90802 1171.4
891.06 1154.6
892.21198 1144
893.36401 1128
894.51599 1131
895.66602 1147.4
896.81799 1109
897.96899 1151.6
899.12 1116
900.26898 1106.4
901.41998 1131.8
902.57098 1116
903.72101 1121.8
904.87 1088.8
906.02002 1124.4
907.16998 1081.6
908.31799 1099.6
909.46698 1093
910.617 1068.8
911.76398 1084.4
912.91302 1062.4
914.06201 1091.4
915.20898 1072.8
916.35797 1058.2
917.50403 1076.8
918.65198 1061.8
919.79999 1037.6
920.94702 1071
922.09399 1032.8
923.23999 1031.6
924.38702 1031.6
925.53302 1035.8
926.67999 1051
927.82501 1019.6
928.97101 1005.8
930.11603 1043.2
931.26202 1014.2
932.40698 1023.6
933.55298 1000.2
934.69702 998.79999
935.84198 1005
936.98602 1009.6
938.13098 989.79999
939.27502 996.20001
940.41901 978.79999
941.56201 994.20001
942.70502 989.40002
943.84998 963
944.992 956.59998
946.13599 976.59998
947.27802 952.40002
948.41998 981
949.56403 932.40002
950.70502 932
951.84698 923
952.98999 919
954.13098 942.79999
955.27197 922.40002
956.414 911
957.55499 933
958.69501 915.20001
959.83698 907.59998
960.97699 923.79999
962.117 925.20001
963.25702 897.79999
964.39801 909.59998
965.53699 906.20001
966.677 894.40002
967.81598 902.40002
968.95502 877.40002
970.09497 891
971.23401 870.40002
972.37201 853.79999
973.51001 867.79999
974.64801 881
975.78601 860
976.92499 868.59998
978.06299 877.20001
979.20001 862.79999
980.33698 846
981.474 866.20001
982.61102 852.59998
983.74799 851.20001
984.88397 843.79999
986.021 819.59998
987.15698 840.20001
988.29303 831.79999
989.42902 821.20001
990.565 805.79999
991.70099 805.59998
992.836 821.59998
993.97101 805.59998
995.10602 802.20001
996.24103 788.20001
997.37598 813.40002
998.50897 800.20001
999.64301 801.59998
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