#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-06-07 11:41:19 +0300 (Thu, 07 Jun 2018) $ #$Revision: 1228 $ #$URL: svn://172.16.1.111/rod/cif/1/00/06/1000640.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_1000640 loop_ _publ_author_name 'Hazen, R. M.' 'Burnham, C. W.' _publ_section_title ; The crystal structures of one-layer phlogopite and annite ; _journal_name_full 'American Mineralogist' _journal_page_first 889 _journal_page_last 900 _journal_volume 58 _journal_year 1973 _chemical_compound_source R060204 _chemical_formula_sum 'Al1.282 Ca0.03 Cl0.05 F0.22 Fe2.43 H1.38 K0.88 Mg0.12 Mn0.03 Na0.07 O11.73 Si2.808 Ti0.21' _chemical_name_mineral Annite _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 100.63 _cell_angle_gamma 90 _cell_length_a 5.3860 _cell_length_b 9.3241 _cell_length_c 10.2683 _cell_volume 506.820 _exptl_crystal_density_diffrn 3.250 _cod_original_formula_sum ;Al1.282 Ca0.03 Cl0.05 F0.22 Fe2.43 H1.38 K0.88 Mg0.12 Mn0.03 Na0.07 O11.73 Si2.808 Ti0.21 ; _cod_database_code 9000377 _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 helium-neon _raman_measurement_device.excitation_laser_wavelength 780 _raman_measurement_device.configuration simple _raman_measurement_device.resolution 4 _raman_measurement_device.power_on_sample 12 _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 R060204.rod _rod_data_source.block 3500000 _rod_database.code 1000640 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 9000377 COD http://www.crystallography.net/cod/9000377.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 145.3421 0.0000000E+00 145.8242 0.2505490 146.3063 0.4784240 146.7884 0.1232450 147.2706 0.1681670 147.7527 0.1430050 148.2348 0.2596740 148.7169 0.8653560 149.1990 1.288483 149.6811 1.381836 150.1633 1.755020 150.6454 2.758972 151.1275 4.240952 151.6096 5.715118 152.0917 6.997482 152.5738 8.181641 153.0560 9.482773 153.5381 10.96347 154.0202 12.33237 154.5023 13.17772 154.9844 13.45793 155.4665 14.06393 155.9487 15.55583 156.4308 17.41435 156.9129 19.31224 157.3950 21.19991 157.8771 22.98276 158.3592 24.41077 158.8414 25.15196 159.3235 26.39668 159.8056 28.67355 160.2877 31.38808 160.7698 34.10699 161.2519 36.64706 161.7341 39.01080 162.2162 41.17088 162.6983 42.92825 163.1804 44.75923 163.6625 46.58371 164.1446 48.55070 164.6268 50.83754 165.1089 53.56651 165.5910 56.67427 166.0731 59.79993 166.5552 63.12671 167.0373 66.26598 167.5195 68.94536 168.0016 71.38469 168.4837 74.04887 168.9658 77.26983 169.4479 81.01219 169.9300 84.37968 170.4122 87.30460 170.8943 90.01127 171.3764 92.59585 171.8585 95.04858 172.3406 97.33376 172.8227 99.44238 173.3049 101.3134 173.7870 102.8819 174.2691 104.0350 174.7512 104.9771 175.2333 105.8495 175.7154 106.6596 176.1976 107.4061 176.6797 108.2370 177.1618 109.0097 177.6439 109.2876 178.1260 108.8447 178.6081 107.9400 179.0903 106.9673 179.5724 105.7334 180.0545 104.4141 180.5366 102.8076 181.0187 100.7229 181.5008 98.51695 181.9830 96.38389 182.4651 94.16135 182.9472 91.61364 183.4293 89.01635 183.9114 86.33628 184.3935 83.48955 184.8757 80.68890 185.3578 78.08059 185.8399 75.67745 186.3220 73.40484 186.8041 70.73902 187.2862 66.90917 187.7684 63.24660 188.2505 60.45256 188.7326 58.31802 189.2147 56.14735 189.6968 53.46776 190.1789 50.24270 190.6611 47.35980 191.1432 45.02361 191.6253 42.82556 192.1074 40.68820 192.5895 38.60370 193.0716 36.56310 193.5538 34.58792 194.0359 32.67026 194.5180 30.77815 195.0001 28.82336 195.4822 26.96973 195.9643 25.32033 196.4465 23.85849 196.9286 22.48167 197.4107 21.12688 197.8928 19.80637 198.3749 18.33738 198.8570 16.47998 199.3392 14.67064 199.8213 13.15571 200.3034 11.96175 200.7855 11.06149 201.2676 10.51567 201.7497 10.34505 202.2319 9.946701 202.7140 9.099617 203.1961 8.151787 203.6782 7.386818 204.1603 6.837570 204.6424 6.372047 205.1246 5.885780 205.6067 5.389595 206.0888 4.906517 206.5709 4.494743 207.0530 4.074219 207.5351 3.490013 208.0173 2.672340 208.4994 1.902321 208.9815 1.427254 209.4636 1.160690 209.9457 0.9602970 210.4278 0.8501510 210.9100 0.7600560 211.3921 0.4849170 211.8742 0.1081850 212.3563 0.5986180 212.8384 0.6172100 213.3205 0.3760220 213.8027 0.2741240 214.2848 0.6831050 214.7669 1.381363 215.2490 1.492935 215.7311 0.5740360 216.2132 0.2570270 216.6953 0.5564420 217.1775 0.4558030 217.6596 0.1543120 218.1417 0.3283390 218.6238 0.9118420 219.1059 1.070511 219.5880 0.2774960 220.0702 0.2999570 220.5523 0.1519240 221.0344 0.4127810 221.5165 0.8789980 221.9986 0.8831180 222.4807 0.4873350 222.9629 0.2789230 223.4450 0.4051280 223.9271 0.5839770 224.4092 0.8759990 224.8913 1.170509 225.3734 1.274742 225.8556 1.037956 226.3377 0.5044100 226.8198 0.1810610 227.3019 0.3161930 227.7840 0.4099120 228.2661 0.4294200 228.7483 0.3282930 229.2304 2.2774000E-02 229.7125 0.7523500 230.1946 1.778725 230.6767 2.177193 231.1588 1.235336 231.6410 0.4976270 232.1231 0.4473720 232.6052 0.8739320 233.0873 1.329422 233.5694 1.539246 234.0515 1.552887 234.5337 1.734634 235.0158 2.295349 235.4979 2.760712 235.9800 2.932693 236.4621 2.902962 236.9442 2.887741 237.4264 3.020294 237.9085 3.244003 238.3906 3.293297 238.8727 2.971497 239.3548 2.732796 239.8369 2.799347 240.3191 3.072380 240.8012 3.292854 241.2833 3.300629 241.7654 3.208931 242.2475 3.356842 242.7296 3.847977 243.2118 4.362427 243.6939 4.806213 244.1760 5.172905 244.6581 5.436310 245.1402 5.573257 245.6223 5.604980 246.1045 5.572258 246.5866 5.445396 247.0687 5.355927 247.5508 5.392662 248.0329 5.524147 248.5150 5.630875 248.9972 5.643997 249.4793 5.657402 249.9614 5.834328 250.4435 6.209343 250.9256 6.516075 251.4077 6.530724 251.8899 6.326370 252.3720 6.243057 252.8541 6.447960 253.3362 6.699692 253.8183 6.685242 254.3004 6.407913 254.7826 6.218643 255.2647 6.459389 255.7468 7.019386 256.2289 7.284828 256.7110 6.896744 257.1931 6.535126 257.6753 6.389320 258.1574 7.329247 258.6395 7.965454 259.1216 8.304359 259.6037 7.484329 260.0858 8.157417 260.5680 8.230911 261.0501 8.279442 261.5322 9.161873 262.0143 8.509399 262.4964 9.459854 262.9785 9.624207 263.4607 9.614212 263.9428 9.778145 264.4249 10.32611 264.9070 10.73785 265.3891 10.64835 265.8712 10.26110 266.3534 9.989830 266.8355 10.12171 267.3176 10.56172 267.7997 10.92204 268.2818 11.26373 268.7639 11.40395 269.2461 11.14884 269.7282 10.69429 270.2103 10.33233 270.6924 10.25134 271.1745 10.42970 271.6566 10.71004 272.1388 10.47064 272.6209 11.11861 273.1030 11.44424 273.5851 11.53444 274.0672 10.51323 274.5493 10.99163 275.0315 10.86848 275.5136 10.71175 275.9957 11.35750 276.4778 10.23136 276.9599 10.20053 277.4420 10.58016 277.9242 11.02338 278.4063 11.37516 278.8884 11.56695 279.3705 11.52810 279.8526 11.25812 280.3347 10.85608 280.8169 10.15289 281.2990 9.423409 281.7811 8.901787 282.2632 8.631561 282.7453 8.473717 283.2274 8.263817 283.7096 8.075493 284.1917 7.730026 284.6738 7.007042 285.1559 6.267273 285.6380 5.710899 286.1201 5.380936 286.6023 5.232750 287.0844 5.264206 287.5665 5.568001 288.0486 5.696602 288.5307 5.521263 289.0128 5.272545 289.4950 5.084534 289.9771 4.940041 290.4592 4.702766 290.9413 4.197784 291.4234 3.383415 291.9055 2.806839 292.3877 2.599007 292.8698 2.497643 293.3519 2.480438 293.8340 2.501480 294.3161 2.492134 294.7982 2.401352 295.2804 2.236938 295.7625 2.099197 296.2446 2.086632 296.7267 1.990372 297.2088 1.676842 297.6909 1.275063 298.1731 0.9867250 298.6552 0.9270940 299.1373 1.031151 299.6194 1.057045 300.1015 0.9667890 300.5836 0.8372420 301.0658 0.5050960 301.5479 0.2071990 302.0300 0.2947850 302.5121 0.8902890 302.9942 1.667900 303.4763 1.928764 303.9585 1.060631 304.4406 0.5869830 304.9227 0.8593600 305.4048 1.293320 305.8869 1.406815 306.3690 1.097076 306.8512 0.6043780 307.3333 0.2503740 307.8154 5.7472002E-02 308.2975 3.3821002E-02 308.7796 2.1354999E-02 309.2617 6.9678999E-02 309.7439 0.2967070 310.2260 0.6158750 310.7081 0.8611530 311.1902 0.8426360 311.6723 0.4955370 312.1544 0.3628390 312.6366 0.6890790 313.1187 0.9569020 313.6008 0.9364320 314.0829 0.6849210 314.5650 0.3637620 315.0471 7.4913003E-02 315.5293 0.1729510 316.0114 0.2579500 316.4935 9.8040001E-03 316.9756 0.2107010 317.4577 0.3588560 317.9398 0.4264140 318.4220 0.3804630 318.9041 0.1969910 319.3862 5.0583001E-02 319.8683 0.1281360 320.3504 0.1149520 320.8326 0.3544460 321.3147 0.5967100 321.7968 0.8172070 322.2789 1.024078 322.7610 1.209633 323.2431 1.306206 323.7253 1.182121 324.2074 0.6443250 324.6895 0.2637250 325.1716 2.4277000E-02 325.6537 0.1423190 326.1358 0.1173100 326.6180 0.6874240 327.1001 1.162498 327.5822 1.055489 328.0643 0.1899030 328.5464 0.3678510 329.0285 0.5167850 329.5107 0.5030520 329.9928 0.3304290 330.4749 7.0450000E-02 330.9570 0.1392440 331.4391 0.1873780 331.9212 8.6898997E-02 332.4034 3.8688999E-02 332.8855 2.7930999E-02 333.3676 3.8582001E-02 333.8497 0.4483950 334.3318 0.9683760 334.8139 1.241020 335.2961 1.080505 335.7782 0.6581500 336.2603 0.4882510 336.7424 0.8255460 337.2245 1.044090 337.7066 1.011154 338.1888 0.8972470 338.6708 0.8634800 339.1530 0.9515300 339.6351 1.093033 340.1172 1.187225 340.5993 1.247704 341.0814 1.229042 341.5635 1.093697 342.0457 0.9223790 342.5278 0.6614690 343.0099 0.3746490 343.4920 0.2516330 343.9741 0.5052110 344.4562 1.161125 344.9384 1.710510 345.4205 2.307114 345.9026 2.622627 346.3847 2.322166 346.8668 1.698059 347.3489 1.277489 347.8311 1.408775 348.3132 1.930748 348.7953 2.186279 349.2774 1.990570 349.7595 1.798569 350.2416 1.633270 350.7238 1.541039 351.2059 1.597893 351.6880 1.827736 352.1701 2.124474 352.6522 2.311562 353.1343 2.356827 353.6165 2.384293 354.0986 2.526146 354.5807 2.565521 355.0628 2.264381 355.5449 1.667831 356.0270 1.116974 356.5092 0.9721070 356.9913 1.251183 357.4734 1.507103 357.9555 1.810738 358.4376 1.999504 358.9197 1.923943 359.4019 1.688492 359.8840 1.499603 360.3661 1.491547 360.8482 1.609100 361.3303 1.665955 361.8124 1.598244 362.2946 1.607376 362.7767 2.019066 363.2588 2.422485 363.7409 1.756699 364.2230 2.425209 364.7051 2.784134 365.1873 2.850990 365.6694 1.759453 366.1515 2.160896 366.6336 1.964081 367.1157 1.744431 367.5978 2.253296 368.0800 2.371170 368.5621 2.404083 369.0442 2.302170 369.5263 2.095161 370.0084 1.962540 370.4905 1.899780 370.9727 1.912651 371.4548 2.167053 371.9369 2.518875 372.4190 2.623688 372.9011 2.194328 373.3832 1.547798 373.8654 1.183884 374.3475 1.148178 374.8296 1.107483 375.3117 0.8660130 375.7938 0.5372920 376.2759 0.2796100 376.7581 0.1052020 377.2402 4.9510002E-03 377.7223 4.8679998E-03 378.2044 9.7015001E-02 378.6865 0.1907580 379.1686 0.2313770 379.6508 0.2861790 380.1329 0.5542140 380.6150 1.038513 381.0971 1.302818 381.5792 0.9825290 382.0613 0.4526900 382.5435 0.3195190 383.0256 0.6578830 383.5077 0.9876560 383.9898 0.8906480 384.4719 0.4660640 384.9540 0.3472600 385.4362 0.8822020 385.9183 1.429878 386.4004 1.577805 386.8825 1.399696 387.3646 1.112892 387.8467 0.7994920 388.3289 0.4915620 388.8110 0.2869110 389.2931 0.1316830 389.7752 0.1500930 390.2573 0.5321880 390.7394 1.029259 391.2216 1.346207 391.7037 1.430206 392.1858 1.379677 392.6679 1.335991 393.1500 1.311783 393.6321 1.247658 394.1143 1.129471 394.5964 0.9911500 395.0785 0.3697280 395.5606 1.107307 396.0427 1.539146 396.5248 1.682793 397.0070 0.6707000 397.4891 1.153877 397.9712 1.038147 398.4533 0.8957600 398.9354 1.585114 399.4175 0.7375260 399.8997 1.413582 400.3818 1.338631 400.8639 1.386856 401.3460 1.435822 401.8281 1.464096 402.3102 1.557480 402.7924 1.828201 403.2745 2.055092 403.7566 2.149086 404.2387 2.101410 404.7208 1.896973 405.2029 1.467194 405.6851 0.8837360 406.1672 0.7587890 406.6493 1.600906 407.1314 2.172607 407.6135 2.060463 408.0956 1.616241 408.5778 1.183807 409.0599 0.8840330 409.5420 0.7197570 410.0241 0.7251280 410.5062 0.9342190 410.9883 1.130814 411.4705 1.267906 411.9526 1.398239 412.4347 1.641495 412.9168 1.938278 413.3989 2.032753 413.8810 1.604607 414.3632 0.8196640 414.8453 0.2780840 415.3274 1.7890999E-02 415.8095 7.0679002E-02 416.2916 0.2535170 416.7737 0.7780760 417.2559 1.341606 417.7380 2.038292 418.2201 2.480934 418.7022 2.085625 419.1843 0.9569930 419.6664 9.9463999E-02 420.1486 0.1645360 420.6307 5.9241999E-02 421.1128 0.1919020 421.5949 0.5898280 422.0770 0.9248350 422.5591 1.132858 423.0413 1.229782 423.5234 1.237373 424.0055 1.158028 424.4876 0.9752810 424.9697 0.6433490 425.4518 0.1881410 425.9340 0.1980210 426.4161 0.6319500 426.8982 0.8788530 427.3803 0.7521290 427.8624 0.3669130 428.3445 7.8171000E-02 428.8267 0.5246050 429.3088 0.8962780 429.7909 1.057106 430.2730 0.9213100 430.7551 0.7393340 431.2372 0.4043660 431.7194 0.1067350 432.2015 1.8340999E-02 432.6836 0.1181110 433.1657 0.2521360 433.6478 0.3038790 434.1299 0.2759320 434.6121 0.1943360 435.0942 5.2551001E-02 435.5763 0.2228780 436.0584 0.3211290 436.5405 0.3045730 437.0226 3.9565999E-02 437.5048 0.4974900 437.9869 1.039833 438.4690 1.129196 438.9511 0.5895540 439.4332 0.1599200 439.9153 0.2445300 440.3975 0.4497600 440.8796 0.1973570 441.3617 0.3437190 441.8438 0.7261510 442.3259 0.6026310 442.8080 0.1427990 443.2902 5.6030001E-02 443.7723 0.1440810 444.2544 0.2493060 444.7365 0.1032870 445.2186 0.5266420 445.7007 0.6337740 446.1829 0.3360060 446.6650 4.8668001E-02 447.1471 0.2857360 447.6292 0.3822100 448.1113 0.3340230 448.5934 3.7094001E-02 449.0756 0.2006450 449.5577 1.0399000E-02 450.0398 0.4657290 450.5219 0.8092190 451.0040 0.7893220 451.4861 0.6757510 451.9683 0.7829900 452.4504 1.065254 452.9325 1.187988 453.4146 0.9647450 453.8967 0.5520860 454.3788 0.2763670 454.8610 0.1093060 455.3431 0.1068800 455.8252 0.4744950 456.3073 0.9039540 456.7894 1.027313 457.2715 0.8099210 457.7537 0.5046080 458.2358 0.2957000 458.7179 0.1834490 459.2000 0.3027270 459.6821 0.8882830 460.1642 1.395683 460.6464 1.642570 461.1285 1.730690 461.6106 1.803543 462.0927 1.915848 462.5748 2.031326 463.0569 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