#------------------------------------------------------------------------------ #$Date: 2018-02-05 18:51:35 +0200 (Mon, 05 Feb 2018) $ #$Revision: 376 $ #$URL: svn://172.16.1.111/rod/cif/3/50/01/3500161.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_3500161 loop_ _publ_author_name 'El Mendili, Y' 'Secchi, M' 'Zannatta, M' _publ_section_title ; Raman spectrum of commercial BaTiO3 ; _journal_name_full 'Personal communication to ROD' _journal_year 2018 _chemical_compound_source 'commercial CRICERAM pur' _chemical_formula_structural 'Ba O3 Ti' _chemical_formula_sum 'Ba O3 Ti' _chemical_name_mineral 'Barium titanate' _chemical_name_systematic BaTiO3 _space_group_IT_number 25 _symmetry_space_group_name_Hall 'P -2 2' _symmetry_space_group_name_H-M 'P 2 m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 1 _cell_length_a 3.98 _cell_length_b 4.01 _cell_length_c 4.02 _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 100 _raman_measurement_device.microscope_numerical_aperture 0.80 _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 10 _raman_measurement.datetime_initiated 2018-01-18 _rod_data_source.file BaTiO3.rod _rod_data_source.block 3500020 _rod_database.code 3500161 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 1540757 COD http://www.crystallography.net/cod/1540757.html ; no XRD analysis data. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 102.305 35675 104.549 36427 106.791 36655.5 109.033 36459.5 111.274 36131.5 113.514 35497 115.755 34872.3 117.994 34399 120.233 33618 122.471 32957 124.708 32162.5 126.944 31571.8 129.18 30917.5 131.415 30341.8 133.65 29993.5 135.884 29637 138.117 29248.5 140.35 28932 142.58 28678 144.812 28499 147.043 28092.5 149.273 27942.8 151.502 27701.8 153.73 27605 155.958 27273.3 158.185 27134.5 160.411 26746.8 162.637 26715.3 164.863 26522.3 167.086 26414 169.311 26409.3 171.533 26197 173.756 26324.3 175.977 26282.5 178.199 26442.3 180.419 26642.8 182.639 26918.5 184.858 27213.5 187.076 27686.8 189.295 28370.5 191.511 28779.5 193.727 28668.8 195.943 28343.3 198.159 28063.5 200.373 27892 202.586 27841.8 204.799 27835.8 207.011 27754 209.225 27846 211.435 27981.3 213.646 27975.8 215.856 27891.5 218.065 27863 220.273 27995.5 222.481 28222.8 224.688 28503.8 226.895 28513 229.101 28803 231.304 28988.5 233.509 29285 235.713 29635.3 237.917 29971.8 240.12 30339.3 242.32 30733.3 244.522 31090.5 246.723 31519 248.923 31887.8 251.121 32239.3 253.321 32794.3 255.518 33003.8 257.715 33309 259.913 33611.8 262.108 33682.3 264.304 33802.3 266.498 33802 268.692 33711.8 270.885 33604.8 273.077 33274.5 275.27 32959 277.461 32712.3 279.651 32179.5 281.842 31648 284.031 31130 286.219 30489.3 288.407 29893.5 290.596 29275.5 292.782 28521.8 294.968 27732.3 297.153 27100.5 299.338 26398 301.522 25926.5 303.705 25617.3 305.888 25735.8 308.07 26567 310.252 28552.8 312.433 31285 314.613 31887.3 316.793 29758.5 318.972 26035 321.15 22859 323.328 20958.5 325.504 19671.3 327.681 18795.5 329.857 18075.5 332.032 17474.5 334.205 16883 336.38 16184.5 338.553 15744.3 340.725 15236.8 342.897 14636.3 345.069 14312.8 347.239 13846.3 349.409 13479.5 351.578 13043.5 353.747 12768 355.914 12383.8 358.081 12029.8 360.248 11739.5 362.414 11459.5 364.58 11098 366.744 10803 368.908 10541.3 371.071 10180.8 373.235 10016.3 375.397 9742.5 377.558 9463.25 379.718 9262 381.878 8985 384.038 8714.5 386.198 8556.5 388.356 8257.5 390.514 8102 392.671 7947.25 394.827 7698.5 396.983 7539 399.138 7387 401.291 7136.5 403.445 7021.5 405.598 6768.75 407.751 6685.5 409.903 6501.25 412.055 6323 414.204 6112 416.354 6001.75 418.504 5943.5 420.652 5724 422.8 5574.25 424.948 5454.75 427.094 5288 429.241 5230.25 431.386 5042.5 433.531 4902.25 435.675 4846 437.819 4717.5 439.961 4585.25 442.104 4456 444.245 4405.5 446.386 4294 448.527 4199.5 450.667 4043 452.805 4072.5 454.945 3921 457.082 3898.25 459.219 3851 461.356 3743 463.491 3786.75 465.627 3806.5 467.763 3860.5 469.896 3946.5 472.03 4059.25 474.163 4134.25 476.295 4242 478.426 4403.75 480.557 4609.75 482.686 4877 484.816 5216 486.945 5625.75 489.074 6149 491.202 6711 493.329 7276.75 495.455 7851.5 497.581 8352.75 499.707 8970.25 501.83 9656.5 503.955 10479.3 506.079 11373.8 508.201 12668.3 510.323 13899.5 512.444 15316.5 514.566 16692.8 516.685 18165.8 518.805 19467 520.924 20642.5 523.043 21522.3 525.16 21988 527.277 22313 529.394 22256.3 531.51 21917.8 533.624 21374 535.74 20541 537.854 19843.8 539.967 19006.5 542.079 18321.5 544.191 17365 546.303 16727.5 548.415 16054.8 550.525 15235.5 552.634 14625.3 554.743 14023.5 556.852 13478 558.96 13046.3 561.065 12465.3 563.172 12056 565.278 11564.8 567.384 11107.5 569.489 10524 571.593 10182 573.695 9778 575.798 9474.5 577.901 9075 580.003 8769 582.103 8587.75 584.204 8278.5 586.303 7980 588.402 7800.5 590.501 7580.5 592.598 7398.5 594.696 7079.5 596.792 7044.75 598.888 6825.75 600.984 6666 603.078 6451 605.173 6349.75 607.266 6199 609.359 5963.5 611.452 5932 613.543 5775 615.634 5668.75 617.724 5570.5 619.814 5450.75 621.903 5377.5 623.993 5332.75 626.081 5252.75 628.168 5239.25 630.255 5150.75 632.341 5123.25 634.427 4960 636.512 4940 638.596 4880 640.679 4779 642.762 4779.75 644.845 4758.5 646.927 4691.75 649.008 4669 651.088 4605.25 653.168 4521.5 655.248 4468.5 657.327 4461.25 659.405 4368 661.483 4330 663.559 4272.75 665.636 4180.25 667.713 4140.75 669.787 4055 671.861 4006 673.936 4001.75 676.008 3921 678.082 3880.25 680.154 3781.75 682.225 3763.75 684.297 3769.5 686.367 3675.5 688.436 3685 690.505 3619.25 692.574 3568.5 694.642 3552.5 696.709 3526 698.776 3487.25 700.842 3538.75 702.907 3516.5 704.972 3555.5 707.036 3592.5 709.1 3684.25 711.163 3765 713.226 3809.5 715.288 3902.25 717.349 3930.25 719.41 4027 721.469 4001.75 723.529 4058.5 725.588 3960 727.647 3915.5 729.703 3744.5 731.761 3582 733.818 3505.25 735.873 3295 737.929 3211.25 739.983 3093.75 742.037 2953.75 744.09 2829 746.144 2777.75 748.195 2669.75 750.248 2615.75 752.298 2562.75 754.348 2457.75 756.399 2420.75 758.448 2375 760.496 2361.5 762.545 2333 764.593 2275.75 766.639 2225.5 768.685 2176.5 770.731 2149.25 772.776 2124.25 774.82 2080.5 776.864 2040.75 778.907 1994 780.95 1979.5 782.992 1963.25 785.034 1917 787.075 1894.25 789.115 1869.75 791.155 1833 793.195 1797.25 795.234 1739 797.27 1750.75 799.308 1695.25 801.345 1655.25 803.381 1614.25 805.417 1567 807.452 1559.25 809.486 1527 811.52 1507.75 813.553 1506 815.586 1456 817.618 1464.25 819.65 1431.75 821.68 1368.5 823.71 1413.75 825.74 1352 827.769 1337.25 829.797 1320.25 831.826 1316.75 833.853 1286.75 835.88 1287.25 837.905 1270.5 839.931 1234.5 841.957 1245.25 843.981 1185 846.005 1189.75 848.028 1147.5 850.051 1116 852.073 1116 854.094 1117.75 856.115 1088.25 858.134 1087.25 860.154 1059.5 862.174 1028.5 864.192 1012 866.211 992 868.227 982.5 870.244 954.5 872.261 923.5 874.275 917.5 876.291 884.75 878.306 883.5 880.319 866 882.333 843.75 884.345 815.5 886.358 803.25 888.369 805 890.38 798 892.39 785.25 894.399 751 896.409 743.5 898.418 726.75 900.425 729.5 902.432 700 904.44 695 906.446 678.25 908.452 679 910.457 670.5 912.461 676 914.465 658.5 916.468 635 918.471 640 920.474 622.25 922.475 623.5 924.476 617.75 926.477 605.25 928.477 612.25 930.477 601.25 932.476 593.5 934.473 611.25 936.471 569.25 938.468 585 940.464 564.25 942.46 563.5 944.456 546.5 946.45 572.5 948.445 574.25 950.437 557.25 952.431 561.25 954.423 539 956.415 549.75 958.406 533.75 960.398 541 962.387 555.25 964.377 535.25 966.366 533.5 968.354 529 970.342 545.75 972.329 528.75 974.315 539 976.303 525.25 978.288 531.25 980.273 542.5 982.257 526.25 984.241 539.75 986.224 538.5 988.207 538 990.189 559 992.171 583.75 994.151 595 996.131 588.5 998.111 562.75 1000.09 549.75 1002.07 512.5 1004.05 506.25 1006.03 493 1008 496.5 1009.98 489.5 1011.95 483 1013.93 464.5 1015.9 467 1017.88 458.5 1019.85 456.5 1021.82 436.25 1023.8 448.75 1025.77 435.75 1027.74 426.5 1029.71 423 1031.68 403 1033.65 392.75 1035.62 421.5 1037.59 393.75 1039.56 400.5 1041.52 378 1043.49 371.25 1045.46 379.5 1047.42 363.75 1049.39 364.75 1051.35 349 1053.32 352.5 1055.28 353 1057.24 345 1059.2 347.5 1061.17 341.5 1063.13 346.25 1065.09 344 1067.05 360.25 1069.01 351.25 1070.97 341.5 1072.92 340.75 1074.88 331.5 1076.84 319.5 1078.8 306.75 1080.75 303.75 1082.71 302.75 1084.66 290.25 1086.62 291 1088.57 285 1090.52 278.5 1092.48 285.75 1094.43 280.75 1096.38 273.5 1098.33 267.5 1100.28 273.5 1102.23 271.75 1104.18 269 1106.13 273.25 1108.08 267.25 1110.03 265 1111.97 263.5 1113.92 268.75 1115.87 255.5 1117.81 260 1119.76 248.5 1121.7 258.75 1123.65 253.5 1125.59 252 1127.53 251.75 1129.47 249.5 1131.42 245.5 1133.36 248.25 1135.3 249.75 1137.24 240.25 1139.18 234.75 1141.11 242.5 1143.05 228.75 1144.99 237.5 1146.93 236.25 1148.86 240.5 1150.8 238.75 1152.74 235.5 1154.67 234.5 1156.6 231.5 1158.54 234.25 1160.47 239.25 1162.4 231.25 1164.34 226.25 1166.27 236.5 1168.2 234.25 1170.13 235.75 1172.06 234 1173.99 224.75 1175.92 240.25 1177.85 225 1179.78 240.5 1181.7 221 1183.63 232 1185.55 242 1187.48 233 1189.41 224.5 1191.33 233.25 1193.25 243 1195.18 241.25 1197.1 232 1199.02 245.25 1200.94 237.25 1202.86 248.5 1204.79 237 1206.71 235.75 1208.63 252 1210.54 240.25 1212.46 241.25 1214.38 236.5 1216.3 240.25 1218.22 240 1220.13 241.75 1222.05 229.75 1223.96 240.75 1225.88 246.75 1227.79 233.25 1229.71 235.75 1231.62 227.5 1233.53 231 1235.44 228.25 1237.35 228.25 1239.26 209 1241.18 218.5 1243.08 228.75 1244.99 222 1246.9 220.75 1248.81 220.5 1250.72 213 1252.63 213.75 1254.53 220.25 1256.44 204.75 1258.34 213.75 1260.25 222 1262.15 204.25 1264.06 202 1265.96 202 1267.86 211.25 1269.76 208.25 1271.67 210.5 1273.57 196 1275.47 201.75 1277.37 203 1279.27 201.5 1281.17 202 1283.06 193.5 1284.96 199.5 1286.86 201 1288.76 184.5 1290.65 201.75 1292.55 188.75 1294.44 195.5 1296.34 193.75 1298.23 185.25 1300.13 202 1302.02 199.25 1303.91 196.5 1305.8 180.25 1307.7 182 1309.59 194.75 1311.48 191 1313.37 189.25 1315.26 195 1317.15 186.5 1319.03 189.5 1320.92 183 1322.81 181.75 1324.7 176.5 1326.58 185 1328.47 188 1330.35 183.75 1332.24 192.25 1334.12 193 1336 192.75 1337.89 172.25 1339.77 182.5 1341.65 182.25 1343.53 179 1345.41 189 1347.29 179.25 1349.17 182.5 1351.05 188.25 1352.93 185 1354.81 183.5 1356.69 193 1358.56 181.5 1360.44 182.25 1362.32 182.25 1364.19 174.5 1366.07 180.75 1367.94 177 1369.81 187.75 1371.69 187.25 1373.56 176.75 1375.43 186.75 1377.31 184 1379.18 180.5 1381.05 189.25 1382.92 185.25 1384.79 185.75 1386.66 189.25 1388.52 195 1390.39 179.5 1392.26 180.5 1394.13 192.75 1395.99 183 1397.86 191.25 1399.73 192.5 1401.59 185.5 1403.45 186.75 1405.32 190.5 1407.18 196.25 1409.04 197.25 1410.91 191 1412.77 203.75 1414.63 189.5 1416.49 197.5 1418.35 200 1420.21 203.75 1422.07 210.75 1423.93 225.25 1425.79 205.75 1427.64 205 1429.5 212.5 1431.36 215 1433.21 206.25 1435.07 213 1436.93 204.5 1438.78 208.25 1440.63 219.5 1442.49 220.5 1444.34 220.75 1446.19 214.75 1448.04 222.5 1449.89 212.75 1451.75 222.75 1453.6 221.5 1455.45 230 1457.3 222 1459.14 222.5 1460.99 214.25 1462.84 213.5 1464.69 233 1466.53 212.75 1468.38 212.75 1470.23 230.25 1472.07 228.5 1473.92 223.25 1475.76 226.5 1477.6 232.75 1479.45 225.5 1481.29 224.5 1483.13 219 1484.97 214 1486.81 227.25 1488.65 218.5 1490.49 219 1492.33 217.25 1494.17 217 1496.01 220.5 1497.85 214.5 1499.69 222 1501.52 214 1503.36 226.25 1505.19 214.25 1507.03 223.75 1508.87 220 1510.7 218.75 1512.53 199.25 1514.37 207.75 1516.2 211 1518.03 211 1519.86 204 1521.69 201.25 1523.53 203 1525.36 198.5 1527.19 210.75 1529.02 202.5 1530.84 201.75 1532.67 190.5 1534.5 190.5 1536.33 198.25 1538.15 191.5 1539.98 195.75 1541.8 188.5 1543.63 189.5 1545.45 193 1547.28 190.75 1549.1 193 1550.93 183.25 1552.75 179.75 1554.57 176 1556.39 183.5 1558.21 175.75 1560.03 181.5 1561.85 175.5 1563.67 173.5 1565.49 181 1567.31 173.25 1569.13 164.5 1570.95 161 1572.76 166.5 1574.58 174 1576.39 163.5 1578.21 165.25 1580.03 163.5 1581.84 170 1583.65 164 1585.47 159 1587.28 165.75 1589.09 161 1590.9 159 1592.72 155.75 1594.53 157.5 1596.34 161.25 1598.15 160.75 1599.96 151.25 1601.76 160.75 1603.57 152.75 1605.38 160.75 1607.19 148.5 1609 155.25 1610.8 163.75 1612.61 150.5 1614.41 154 1616.22 153.75 1618.02 159.5 1619.83 151.75 1621.63 157.5 1623.43 164 1625.23 153.5 1627.04 151.25 1628.84 153.5 1630.64 157.5 1632.44 157 1634.24 150.75 1636.04 156.75 1637.84 155 1639.63 151.5 1641.43 155.5 1643.23 152.25 1645.03 143.5 1646.82 157 1648.62 154.75 1650.42 152.25 1652.21 156.75 1654 147 1655.8 157 1657.59 151 1659.38 144.25 1661.18 150 1662.97 154.25 1664.76 155.25 1666.55 152.75 1668.34 150.75 1670.13 149.5 1671.92 139.25 1673.71 144.5 1675.5 150.5 1677.29 150.75 1679.07 155 1680.86 153.25 1682.65 146.75 1684.43 153.75 1686.22 144.5 1688 144 1689.79 145.25 1691.57 150.5 1693.35 145.75 1695.14 145.75 1696.92 159.5 1698.7 142.5 1700.48 149.75 1702.26 148.5 1704.04 147.5 1705.83 135.75 1707.6 144.5 1709.38 144.75 1711.16 145.25 1712.94 149 1714.72 150.5 1716.49 143.25 1718.27 139.5 1720.05 147 1721.82 146.25 1723.6 144.5 1725.37 147.25 1727.15 142 1728.92 138.5 1730.69 143.5 1732.47 143.5 1734.24 145 1736.01 143.75 1737.78 145.5 1739.55 142.25 1741.32 141.5 1743.09 143.25 1744.86 133.5 1746.63 140.25 1748.4 150 1750.16 143 1751.93 143.5 1753.7 142.25 1755.46 139.5 1757.23 144.5 1759 138.25 1760.76 131.25 1762.52 148.75 1764.29 144.25 1766.05 142.5 1767.82 144.25 1769.58 141.5 1771.34 144.75 1773.1 148 1774.86 137.75 1776.62 137.75 1778.38 137.25 1780.14 142.5 1781.9 142 1783.66 129.25 1785.42 141.25 1787.17 135.75 1788.93 137 1790.69 139.25 1792.44 149.25 1794.2 139.75 1795.95 139.75 1797.71 131.75 1799.46 139.75 1801.22 147.75 1802.97 142.75 1804.72 131.5 1806.48 134.75 1808.23 137.25 1809.98 142 1811.73 136 1813.48 136.25 1815.23 138.75 1816.98 143.25 1818.73 139.25 1820.48 135.5 1822.22 135 1823.97 143.25 1825.72 130.75 1827.46 141 1829.21 135 1830.96 140 1832.7 140.25 1834.44 127.5 1836.19 143.5 1837.93 141.75 1839.68 135.75 1841.42 143.25 1843.16 137.5 1844.9 134.25 1846.64 134 1848.38 130 1850.12 132.25 1851.86 144.75 1853.6 143.75 1855.34 138 1857.08 130 1858.82 130.75 1860.56 130.5 1862.29 130.5 1864.03 133.25 1865.77 134.5 1867.5 131.75 1869.24 134 1870.97 132.5 1872.7 137.5 1874.44 141.5 1876.17 134.75 1877.9 136.75 1879.63 143 1881.37 129.5 1883.1 134.5 1884.83 122 1886.56 136 1888.29 133 1890.02 142.75 1891.75 135.25 1893.47 138.5 1895.2 128 1896.93 134.5 1898.66 138.25 1900.38 137 1902.11 137.25 1903.83 137.5 1905.56 135.25 1907.28 126.25 1909.01 133 1910.73 138.25 1912.45 129.75 1914.18 128.75 1915.9 129.5 1917.62 132.25 1919.34 127.5 1921.06 137 1922.78 137 1924.5 124 1926.22 134.5 1927.94 134 1929.66 135.25 1931.38 124.75 1933.1 133.5 1934.81 129.75 1936.53 125 1938.24 126.75 1939.96 140.5 1941.68 128.75 1943.39 131.25 1945.1 138 1946.82 127 1948.53 129 1950.24 127.5 1951.96 123.75 1953.67 133 1955.38 127.25 1957.09 134 1958.8 128.25 1960.51 132.25 1962.22 123 1963.93 131.25 1965.64 130 1967.35 127.25 1969.05 128.5 1970.76 133.5 1972.47 131.5 1974.17 130.75 1975.88 126.25 1977.58 131.75 1979.29 131.5 1980.99 130 1982.7 133.25 1984.4 124.5 1986.1 138.25 1987.81 133.25 1989.51 123.5 1991.21 126.75 1992.91 127.5 1994.61 125 1996.31 131.5 1998.01 130.25 1999.71 132.5