#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-05-24 15:58:56 +0300 (Thu, 24 May 2018) $ #$Revision: 838 $ #$URL: svn://172.16.1.111/rod/cif/1/00/03/1000325.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_1000325 loop_ _publ_author_name 'Sokolova, E.' 'Camara, F.' _publ_section_title ; From structure topology to chemical composition. III. Titanium silicates: The crystal chemistry of barytolamprophyllite Locality: Mt. Yuksporr, Khibina alkaline massif, Kola Peninsula, Russia ; _journal_name_full 'The Canadian Mineralogist' _journal_page_first 403 _journal_page_last 412 _journal_paper_doi 10.3749/canmin.46.2.403 _journal_volume 46 _journal_year 2008 _chemical_compound_source R120087 _chemical_formula_sum 'Al0.03 Ba0.88 Ca0.13 Fe0.35 K0.61 Mg0.05 Mn0.28 Na2.09 Nb0.01 O18 Si4 Sr0.33 Ti2.91' _chemical_name_mineral Barytolamprophyllite _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 96.676 _cell_angle_gamma 90 _cell_length_a 19.8971 _cell_length_b 7.1165 _cell_length_c 5.4108 _cell_volume 760.962 _exptl_crystal_density_diffrn 3.511 _cod_original_formula_sum ;Al0.03 Ba0.88 Ca0.13 Fe0.35 K0.61 Mg0.05 Mn0.28 Na2.09 Nb0.01 O18 Si4 Sr0.33 Ti2.91 ; _cod_database_code 9010662 _raman_determination_method experimental _raman_measurement_device.location 'Arizona University' _raman_measurement_device.company 'Thermo Scientific' _raman_measurement_device.model 'Nicolet Almega XR' _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 0.5 _raman_measurement_device.excitation_laser_type other _raman_measurement_device.excitation_laser_wavelength 532 _raman_measurement_device.configuration simple _raman_measurement_device.resolution 4 _raman_measurement_device.power_on_sample 15 _raman_measurement_device.direction_polarization unoriented _raman_measurement_device.spot_size 1 _raman_measurement_device.diffraction_grating 400 _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 _rod_data_source.file R120087.rod _rod_data_source.block 3500000 _rod_database.code 1000325 loop_ _raman_complementary.id _raman_complementary.method 1 XRD 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 9010662 COD http://www.crystallography.net/cod/9010662.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 180.6480 0.0000000E+00 181.1301 0.1474460 181.6122 0.2576330 182.0944 0.5824240 182.5765 0.6040990 183.0586 0.2124440 183.5407 0.1684000 184.0228 0.2528990 184.5049 3.6495000E-02 184.9871 0.3645590 185.4692 0.8772200 185.9513 1.478424 186.4334 2.002804 186.9155 2.276104 187.3976 2.403942 187.8798 2.772648 188.3619 3.410011 188.8440 4.196095 189.3261 4.980572 189.8082 5.770000 190.2903 6.530266 190.7725 7.162464 191.2546 7.728607 191.7367 8.575737 192.2188 9.807220 192.7009 11.11251 193.1830 11.83955 193.6652 11.98038 194.1473 12.21263 194.6294 12.94331 195.1115 14.13261 195.5936 15.31454 196.0757 16.47063 196.5579 17.59261 197.0400 18.60392 197.5221 19.48084 198.0042 20.48168 198.4863 21.80918 198.9684 23.46025 199.4506 25.12627 199.9327 26.79574 200.4148 28.43222 200.8969 29.87824 201.3790 31.10563 201.8611 32.40456 202.3433 34.01556 202.8254 35.98053 203.3075 37.75060 203.7896 39.13795 204.2717 40.40152 204.7538 42.28397 205.2360 44.93390 205.7181 47.61496 206.2002 49.81038 206.6823 51.40357 207.1644 53.30551 207.6465 55.73949 208.1287 58.43746 208.6108 60.65886 209.0929 62.31705 209.5750 63.74830 210.0571 65.12724 210.5392 66.47246 211.0214 67.71646 211.5035 68.83857 211.9856 69.86054 212.4677 70.94238 212.9498 72.20544 213.4319 73.27541 213.9140 73.86658 214.3962 73.80619 214.8783 73.92673 215.3604 74.40838 215.8425 75.10934 216.3246 75.45141 216.8067 75.43162 217.2889 75.07176 217.7710 74.29289 218.2531 72.85936 218.7352 71.72400 219.2173 71.12505 219.6994 70.87382 220.1816 70.06636 220.6637 68.41016 221.1458 66.68574 221.6279 65.45209 222.1100 65.00029 222.5921 64.42891 223.0743 63.63771 223.5564 62.70195 224.0385 61.76518 224.5206 60.70227 225.0027 59.54507 225.4848 58.38561 225.9670 57.12925 226.4491 55.92653 226.9312 54.80632 227.4133 53.71120 227.8954 52.53796 228.3775 51.07185 228.8597 49.52615 229.3418 48.21715 229.8239 47.31268 230.3060 46.29745 230.7881 45.09476 231.2702 43.74402 231.7524 42.44659 232.2345 41.08369 232.7166 39.95219 233.1987 39.31656 233.6808 39.57857 234.1629 39.41965 234.6451 38.56171 235.1272 37.20398 235.6093 36.24316 236.0914 35.95007 236.5735 35.68264 237.0556 35.04578 237.5378 33.75029 238.0199 32.72682 238.5020 32.06567 238.9841 31.71478 239.4662 31.36110 239.9483 31.00585 240.4305 30.65228 240.9126 30.30750 241.3947 29.99477 241.8768 29.63145 242.3589 29.23734 242.8410 28.79101 243.3232 28.21155 243.8053 27.37863 244.2874 26.57883 244.7695 25.96712 245.2516 25.61130 245.7337 25.29453 246.2159 25.11265 246.6980 24.94773 247.1801 24.38329 247.6622 23.12376 248.1443 21.90095 248.6264 21.11490 249.1086 21.05389 249.5907 20.71805 250.0728 20.00654 250.5549 19.03648 251.0370 18.12108 251.5191 17.31114 252.0013 16.47681 252.4834 15.51441 252.9655 14.27799 253.4476 13.34378 253.9297 12.86292 254.4118 12.61933 254.8940 12.10489 255.3761 11.19227 255.8582 10.22972 256.3403 9.348434 256.8224 8.542152 257.3046 7.856155 257.7867 7.376488 258.2688 6.965088 258.7509 6.359146 259.2330 5.537277 259.7151 4.569824 260.1973 3.383842 260.6794 1.849312 261.1615 0.7891920 261.6436 0.3602520 262.1257 0.2792510 262.6078 7.9117000E-02 263.0900 0.2889180 263.5721 0.6517790 264.0542 0.9333800 264.5363 1.112709 265.0184 1.359291 265.5005 1.690582 265.9827 2.067513 266.4648 2.476723 266.9469 2.985504 267.4290 3.317993 267.9111 3.332085 268.3932 3.000298 268.8754 2.837891 269.3575 2.915039 269.8396 3.056625 270.3217 3.022179 270.8038 2.760010 271.2859 2.535538 271.7681 2.454865 272.2502 2.511185 272.7323 2.413452 273.2144 2.097450 273.6965 1.765762 274.1786 1.715317 274.6608 2.041290 275.1429 2.111755 275.6250 1.708885 276.1071 0.9031520 276.5892 0.1856540 277.0714 0.4292220 277.5535 0.9609910 278.0356 1.397858 278.5177 1.727753 278.9998 2.094673 279.4819 2.569160 279.9641 3.095657 280.4462 3.362434 280.9283 3.312943 281.4104 3.247574 281.8925 3.472046 282.3746 3.992836 282.8568 4.328125 283.3389 4.297585 283.8210 4.114983 284.3031 4.452545 284.7852 5.370712 285.2673 6.332878 285.7495 6.934418 286.2316 7.207840 286.7137 7.535408 287.1958 7.940063 287.6779 8.461769 288.1600 9.225677 288.6422 10.23476 289.1243 11.30129 289.6064 12.35728 290.0885 13.38074 290.5706 14.16982 291.0527 14.66003 291.5349 15.01865 292.0170 15.44567 292.4991 15.94337 292.9812 16.60922 293.4633 17.62790 293.9454 18.86301 294.4276 19.79372 294.9097 20.31420 295.3918 20.83694 295.8739 21.97324 296.3560 23.60156 296.8381 25.20380 297.3203 26.46460 297.8024 27.52591 298.2845 28.72261 298.7666 30.08150 299.2487 31.41709 299.7308 32.49929 300.2130 33.41733 300.6951 34.40751 301.1772 35.55702 301.6593 36.83217 302.1414 38.25813 302.6235 39.81802 303.1057 41.36251 303.5878 42.78812 304.0699 44.09844 304.5520 45.25546 305.0341 46.09879 305.5162 46.91983 305.9984 48.10374 306.4805 49.59166 306.9626 51.05929 307.4447 52.23280 307.9268 53.25972 308.4089 54.31932 308.8911 55.50653 309.3732 56.66583 309.8553 57.72333 310.3374 58.65872 310.8195 59.42371 311.3016 60.02341 311.7838 60.41020 312.2659 60.47897 312.7480 60.04005 313.2301 59.68414 313.7122 59.91884 314.1943 60.49263 314.6765 60.87051 315.1586 60.75092 315.6407 60.40552 316.1228 60.00163 316.6049 59.57605 317.0870 59.03016 317.5692 58.41828 318.0513 57.64413 318.5334 56.57361 319.0155 54.69916 319.4976 52.91451 319.9797 51.75467 320.4619 51.31496 320.9440 50.62802 321.4261 49.24780 321.9082 47.56680 322.3903 45.96189 322.8724 44.31403 323.3546 42.93521 323.8367 42.06422 324.3188 41.67326 324.8009 41.04984 325.2830 40.00311 325.7651 38.77557 326.2473 37.53348 326.7294 35.96490 327.2115 34.73264 327.6936 33.99991 328.1757 33.70442 328.6578 33.46506 329.1400 33.19695 329.6221 33.04282 330.1042 33.07443 330.5863 33.51696 331.0684 33.80287 331.5505 33.82370 332.0327 33.69083 332.5148 33.65690 332.9969 33.72559 333.4790 33.93091 333.9611 34.25957 334.4432 34.63268 334.9254 35.42000 335.4075 36.83555 335.8896 38.44733 336.3717 39.61646 336.8538 40.11593 337.3359 40.71110 337.8180 41.73921 338.3001 43.18213 338.7823 43.86403 339.2644 43.47911 339.7465 42.93145 340.2286 43.23979 340.7107 44.61127 341.1928 45.58144 341.6750 45.74144 342.1571 45.33057 342.6392 45.31348 343.1213 45.76591 343.6034 46.21119 344.0855 46.26705 344.5677 45.95111 345.0498 45.67230 345.5319 45.48380 346.0140 45.34978 346.4961 45.25298 346.9782 45.18867 347.4604 45.00694 347.9425 44.56790 348.4246 43.93326 348.9067 43.35188 349.3888 42.84667 349.8709 42.34484 350.3531 41.67567 350.8352 40.91036 351.3173 40.31631 351.7994 40.11531 352.2815 40.11465 352.7636 40.01104 353.2458 39.80275 353.7279 39.51952 354.2100 39.24981 354.6921 38.91131 355.1742 38.35621 355.6563 37.43733 356.1385 36.38007 356.6206 35.22880 357.1027 34.05011 357.5848 33.20652 358.0669 33.30160 358.5490 33.62906 359.0312 33.47369 359.5133 32.50248 359.9954 31.47024 360.4775 30.81343 360.9596 30.41097 361.4417 30.01626 361.9239 29.57528 362.4060 29.07543 362.8881 28.53600 363.3702 27.98338 363.8523 27.26128 364.3344 26.10768 364.8166 24.83118 365.2987 23.77418 365.7808 23.33885 366.2629 22.84031 366.7450 22.05724 367.2271 20.98714 367.7093 19.96939 368.1914 19.03063 368.6735 18.16240 369.1556 17.34977 369.6377 16.34119 370.1198 15.73860 370.6020 15.89795 371.0841 16.52625 371.5662 16.54519 372.0483 15.61382 372.5304 14.48831 373.0125 13.42558 373.4947 12.34867 373.9768 11.59421 374.4589 11.24366 374.9410 11.13974 375.4231 11.05480 375.9052 10.99953 376.3874 10.93027 376.8695 10.81767 377.3516 10.66325 377.8337 10.60923 378.3158 10.66132 378.7979 10.80403 379.2801 11.03929 379.7622 11.38445 380.2443 11.80837 380.7264 12.31663 381.2085 12.86182 381.6906 13.36366 382.1728 13.82636 382.6549 14.21331 383.1370 14.33031 383.6191 14.32112 384.1012 14.78526 384.5833 15.81880 385.0655 17.09692 385.5476 18.34177 386.0297 19.51293 386.5118 20.42358 386.9939 20.87953 387.4760 21.09938 387.9582 21.38081 388.4403 21.71764 388.9224 22.03008 389.4045 22.28981 389.8866 22.48283 390.3687 22.57664 390.8509 22.48422 391.3330 22.37283 391.8151 22.42400 392.2972 22.56682 392.7793 22.54684 393.2614 22.21173 393.7436 21.70013 394.2257 21.09164 394.7078 20.41036 395.1899 19.61890 395.6720 18.58562 396.1541 17.45025 396.6363 16.44067 397.1184 15.67212 397.6005 14.98756 398.0826 14.35938 398.5647 13.79556 399.0468 13.20998 399.5290 12.54761 400.0111 11.88916 400.4932 11.29548 400.9753 10.73709 401.4574 10.28606 401.9395 10.01057 402.4217 9.862740 402.9038 9.609753 403.3859 9.136055 403.8680 8.727112 404.3501 8.521717 404.8322 8.558208 405.3144 8.696228 405.7965 8.990284 406.2786 9.321861 406.7607 9.481422 407.2428 9.435806 407.7249 9.393486 408.2071 9.403282 408.6892 9.471104 409.1713 9.643867 409.6534 9.923077 410.1355 10.29957 410.6176 10.88511 411.0998 11.61159 411.5819 12.03336 412.0640 11.97601 412.5461 11.72383 413.0282 11.78039 413.5103 12.08793 413.9925 12.30365 414.4746 12.03490 414.9567 11.60850 415.4388 11.64872 415.9209 12.26241 416.4030 12.79043 416.8852 12.47766 417.3673 11.74437 417.8494 11.27462 418.3315 11.58999 418.8136 12.03646 419.2957 12.18321 419.7779 12.07213 420.2600 11.98505 420.7421 12.15677 421.2242 12.33848 421.7063 12.33774 422.1884 12.00097 422.6706 11.70364 423.1527 11.59196 423.6348 11.57195 424.1169 11.46539 424.5990 11.16811 425.0811 10.85015 425.5633 10.57754 426.0454 10.36899 426.5275 10.06711 427.0096 9.594379 427.4917 9.081509 427.9738 8.631603 428.4560 8.262474 428.9381 7.929710 429.4202 7.685181 429.9023 7.468975 430.3844 7.015785 430.8665 6.254017 431.3487 5.469101 431.8308 4.831398 432.3129 4.357563 432.7950 3.734509 433.2771 2.910721 433.7592 2.077187 434.2414 1.471836 434.7235 1.082481 435.2056 0.7666360 435.6877 0.5163310 436.1698 0.2884330 436.6519 5.5916000E-02 437.1341 0.5074310 437.6162 0.9010850 438.0983 1.069344 438.5804 1.114540 439.0625 1.206284 439.5446 1.369881 440.0268 1.592129 440.5089 1.972427 440.9910 2.402039 441.4731 2.650272 441.9552 2.504715 442.4373 2.236671 442.9195 1.960377 443.4016 1.687214 443.8837 1.545498 444.3658 1.721149 444.8479 1.977642 445.3300 2.125542 445.8122 2.059132 446.2943 1.977325 446.7764 1.926491 447.2585 1.885910 447.7406 1.802399 448.2227 1.690609 448.7049 1.515282 449.1870 1.237801 449.6691 0.8274270 450.1512 0.5069240 450.6333 0.3139720 451.1154 0.1697200 451.5976 1.9112000E-02 452.0797 0.1090580 452.5618 0.3473210 453.0439 0.7484780 453.5260 1.257481 454.0081 1.737804 454.4903 2.207886 454.9724 2.625526 455.4545 2.900940 455.9366 3.044758 456.4187 3.313446 456.9008 3.734955 457.3830 4.200768 457.8651 4.582623 458.3472 4.891430 458.8293 5.143581 459.3114 5.269550 459.7935 5.430969 460.2757 5.851227 460.7578 6.485271 461.2399 7.141365 461.7220 7.776962 462.2041 8.368065 462.6862 8.856304 463.1684 9.205997 463.6505 9.581768 464.1326 10.12005 464.6147 10.71528 465.0968 11.23751 465.5789 11.57056 466.0611 11.89223 466.5432 12.26819 467.0253 12.69324 467.5074 13.08834 467.9895 13.38684 468.4716 13.70141 468.9538 14.09547 469.4359 14.65275 469.9180 15.09220 470.4001 15.35162 470.8822 15.53817 471.3643 15.85631 471.8465 16.42844 472.3286 16.75850 472.8107 16.63092 473.2928 16.14912 473.7749 15.90063 474.2570 15.91075 474.7392 16.03255 475.2213 16.29597 475.7034 16.63558 476.1855 16.51276 476.6676 15.76908 477.1497 14.90626 477.6319 14.68999 478.1140 14.94232 478.5961 15.08754 479.0782 14.68406 479.5603 14.16130 480.0424 14.09802 480.5246 14.43502 481.0067 14.69627 481.4888 14.48291 481.9709 14.11593 482.4530 13.88667 482.9352 13.90209 483.4173 13.92898 483.8994 13.83642 484.3815 13.70495 484.8636 13.65924 485.3457 13.78135 485.8279 13.93586 486.3100 14.12049 486.7921 14.33325 487.2742 14.44963 487.7563 14.35938 488.2384 14.28638 488.7206 14.35141 489.2027 14.56937 489.6848 14.92123 490.1669 15.53686 490.6490 16.14676 491.1311 16.28111 491.6133 15.87786 492.0954 15.41658 492.5775 14.99511 493.0596 14.63968 493.5417 14.46701 494.0238 14.47732 494.5060 14.52594 494.9881 14.57563 495.4702 14.57010 495.9523 14.35541 496.4344 13.89527 496.9165 13.33298 497.3987 12.81440 497.8808 12.28804 498.3629 11.66320 498.8450 10.70241 499.3271 9.809158 499.8092 9.403053 500.2914 9.387367 500.7735 9.207512 501.2556 8.464287 501.7377 7.616371 502.2198 6.931297 502.7019 6.524441 503.1841 6.040798 503.6662 5.331902 504.1483 4.586544 504.6304 4.034637 505.1125 3.837692 505.5946 3.580509 506.0768 3.180946 506.5589 2.674274 507.0410 2.212421 507.5231 1.798679 508.0052 1.446358 508.4873 1.156601 508.9695 0.9294320 509.4516 0.7538070 509.9337 0.6401980 510.4158 0.5308300 510.8979 0.3606680 511.3800 0.1344600 511.8622 0.1397510 512.3443 0.5378950 512.8264 0.8750610 513.3085 0.8293760 513.7906 0.4940910 514.2728 0.1967620 514.7549 0.1523970 515.2370 0.2082140 515.7191 0.2340810 516.2012 0.2174070 516.6833 0.2222820 517.1655 0.3726960 517.6476 0.5078510 518.1297 0.4889530 518.6118 0.1640010 519.0939 0.1633950 519.5760 0.4910280 520.0582 0.7861820 520.5403 0.9808240 521.0224 1.007835 521.5045 1.021465 521.9866 1.029762 522.4688 1.033344 522.9509 1.212078 523.4330 1.612278 523.9151 2.079823 524.3972 2.489239 524.8793 2.836239 525.3615 3.263439 525.8436 3.807972 526.3257 4.375011 526.8078 4.787193 527.2899 5.080521 527.7720 5.422932 528.2542 5.914181 528.7363 6.458691 529.2184 6.969276 529.7005 7.433441 530.1826 7.807339 530.6647 8.010635 531.1469 8.142967 531.6290 8.289021 532.1111 8.462132 532.5932 8.639503 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