#\#CIF_2.0 #------------------------------------------------------------------------------ #$Date: 2018-06-07 11:35:10 +0300 (Thu, 07 Jun 2018) $ #$Revision: 1167 $ #$URL: svn://172.16.1.111/rod/cif/1/00/05/1000586.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_1000586 loop_ _publ_author_name 'Orlandi, P.' 'Pasero, M.' 'Vezzalini, G.' _publ_section_title ; Calcio-ancylite-(Nd), a new REE-carbonate from Baveno, Italy Locality: Baveno, Italy ; _journal_name_full 'European Journal of Mineralogy' _journal_page_first 413 _journal_page_last 418 _journal_paper_doi 10.1127/ejm/2/3/0413 _journal_volume 2 _journal_year 1990 _chemical_compound_source R060205 _chemical_formula_sum 'C4 Ca1.263 Ce0.626 Dy0.068 Gd0.273 La0.137 Nd0.879 O16 Pr0.147 Sm0.324 Tm0.029 Y0.254' _chemical_name_mineral Calcioancylite-(Nd) _symmetry_space_group_name_H-M 'P m 1 1' _cell_angle_alpha 90.04 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 4.976 _cell_length_b 8.468 _cell_length_c 7.212 _cell_volume 303.890 _exptl_crystal_density_diffrn 4.038 _cod_original_formula_sum ;C4 Ca1.263 Ce0.626 Dy0.068 Gd0.273 La0.137 Nd0.879 O16 Pr0.147 Sm0.324 Tm0.029 Y0.254 ; _cod_database_code 9005040 _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 R060205.rod _rod_data_source.block 3500000 _rod_database.code 1000586 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 9005040 COD http://www.crystallography.net/cod/9005040.html ; XRD analysis data was done. ; loop_ _raman_spectrum.raman_shift _raman_spectrum.intensity 91.82715 0.0000000E+00 92.30927 2.1118000E-02 92.79138 1.162155 93.27350 2.087341 93.75562 2.380905 94.23773 2.236069 94.71985 1.883362 95.20197 1.463074 95.68408 1.185471 96.16620 1.046600 96.64832 1.174423 97.13043 1.336136 97.61255 1.374313 98.09467 1.535217 98.57678 1.929871 99.05890 1.992966 99.54102 1.968758 100.0231 1.923637 100.5052 1.795883 100.9874 1.495354 101.4695 1.121590 101.9516 1.295921 102.4337 2.625893 102.9158 3.927963 103.3979 4.939964 103.8801 5.760765 104.3622 6.614349 104.8443 7.703201 105.3264 9.081696 105.8085 10.40633 106.2906 11.79768 106.7728 12.91950 107.2549 13.57761 107.7370 13.72999 108.2191 13.57785 108.7012 13.29063 109.1833 12.83940 109.6655 12.72950 110.1476 13.30757 110.6297 14.25299 111.1118 14.96877 111.5939 15.38030 112.0760 15.74797 112.5582 15.85110 113.0403 15.90727 113.5224 16.59948 114.0045 18.06413 114.4866 18.64867 114.9687 19.03369 115.4509 19.22994 115.9330 18.67190 116.4151 19.08784 116.8972 19.11345 117.3793 19.12306 117.8614 19.67608 118.3436 19.57465 118.8257 19.72527 119.3078 19.29160 119.7899 18.27891 120.2720 17.51573 120.7541 17.77410 121.2363 17.83290 121.7184 17.70296 122.2005 16.81875 122.6826 16.90851 123.1647 16.60795 123.6468 16.29139 124.1290 16.21139 124.6111 15.43186 125.0932 14.24046 125.5753 13.27174 126.0574 12.61475 126.5395 12.02646 127.0217 11.45155 127.5038 10.87511 127.9859 10.24238 128.4680 9.466873 128.9501 8.594971 129.4323 7.874893 129.9144 7.517204 130.3965 7.206779 130.8786 6.523521 131.3607 5.356285 131.8428 4.278145 132.3250 3.922752 132.8071 3.966301 133.2892 3.844337 133.7713 3.096779 134.2534 1.963470 134.7355 1.309364 135.2176 1.460983 135.6998 1.680382 136.1819 1.591881 136.6640 1.265945 137.1461 0.8914870 137.6282 0.5866390 138.1103 0.3459930 138.5925 0.2328490 139.0746 0.4479220 139.5567 0.6272430 140.0388 0.6337430 140.5209 0.4630580 141.0030 0.1935500 141.4852 9.2460997E-02 141.9673 0.4153060 142.4494 0.6963650 142.9315 0.9563450 143.4136 1.171448 143.8957 1.304909 144.3779 1.355019 144.8600 1.376213 145.3421 1.479836 145.8242 1.924271 146.3063 1.917778 146.7884 0.8174670 147.2706 0.5596390 147.7527 1.139961 148.2348 0.4858400 148.7169 0.8582840 149.1990 1.912384 149.6811 2.490608 150.1633 2.595520 150.6454 1.744949 151.1275 0.2474440 151.6096 0.8866650 152.0917 1.178009 152.5738 0.9992140 153.0560 0.9748230 153.5381 1.111122 154.0202 1.375595 154.5023 1.783997 154.9844 2.340668 155.4665 2.893921 155.9487 3.392769 156.4308 3.855118 156.9129 4.303993 157.3950 4.753548 157.8771 5.146011 158.3592 5.356949 158.8414 5.263947 159.3235 5.293007 159.8056 5.538010 160.2877 5.950485 160.7698 6.556892 161.2519 7.384933 161.7341 8.280327 162.2162 8.761887 162.6983 8.387825 163.1804 8.176048 163.6625 8.182930 164.1446 8.446167 164.6268 9.031845 165.1089 9.995712 165.5910 11.27376 166.0731 12.49236 166.5552 13.74234 167.0373 14.83862 167.5195 15.69691 168.0016 16.37593 168.4837 16.96130 168.9658 17.47504 169.4479 17.95029 169.9300 18.73804 170.4122 19.95226 170.8943 21.29137 171.3764 22.83530 171.8585 24.46817 172.3406 25.71156 172.8227 26.04245 173.3049 25.59740 173.7870 25.77019 174.2691 27.25372 174.7512 28.87552 175.2333 29.51959 175.7154 29.11960 176.1976 28.75500 176.6797 29.33820 177.1618 30.56404 177.6439 31.69193 178.1260 32.52295 178.6081 33.19284 179.0903 33.94463 179.5724 34.83980 180.0545 35.61234 180.5366 35.95358 181.0187 36.08640 181.5008 36.35429 181.9830 36.94746 182.4651 37.77904 182.9472 38.68788 183.4293 40.07326 183.9114 40.83092 184.3935 40.18797 184.8757 38.72475 185.3578 37.43867 185.8399 37.04118 186.3220 37.43089 186.8041 37.53459 187.2862 37.15970 187.7684 36.68005 188.2505 36.30240 188.7326 35.90192 189.2147 35.19516 189.6968 33.89676 190.1789 31.98288 190.6611 30.50061 191.1432 30.09834 191.6253 29.46933 192.1074 27.98331 192.5895 25.86960 193.0716 23.81474 193.5538 22.44408 194.0359 21.88190 194.5180 20.79276 195.0001 18.72899 195.4822 16.66415 195.9643 15.04927 196.4465 13.88348 196.9286 12.92381 197.4107 11.93272 197.8928 10.88486 198.3749 10.01207 198.8570 9.434830 199.3392 8.908859 199.8213 8.249023 200.3034 7.457687 200.7855 6.684311 201.2676 6.068741 201.7497 5.645279 202.2319 5.334595 202.7140 4.908981 203.1961 4.682617 203.6782 5.251663 204.1603 6.775757 204.6424 8.093994 205.1246 7.795334 205.6067 6.182510 206.0888 4.833633 206.5709 4.136505 207.0530 3.793884 207.5351 3.421631 208.0173 2.998520 208.4994 2.800629 208.9815 3.161072 209.4636 3.866226 209.9457 4.529709 210.4278 4.965317 210.9100 5.270493 211.3921 5.659164 211.8742 6.137527 212.3563 6.720001 212.8384 7.441269 213.3205 8.239975 213.8027 9.025284 214.2848 9.730759 214.7669 10.38385 215.2490 11.08826 215.7311 11.93378 216.2132 12.68745 216.6953 13.20116 217.1775 13.57544 217.6596 13.98094 218.1417 14.50826 218.6238 15.15207 219.1059 15.89012 219.5880 16.90192 220.0702 17.77292 220.5523 18.28590 221.0344 18.59433 221.5165 18.92752 221.9986 19.40291 222.4807 20.03554 222.9629 20.98212 223.4450 23.03142 223.9271 24.53603 224.4092 24.99661 224.8913 24.69597 225.3734 24.08026 225.8556 23.40100 226.3377 22.69000 226.8198 22.31383 227.3019 22.41278 227.7840 22.71501 228.2661 23.41196 228.7483 24.25865 229.2304 24.84679 229.7125 24.90956 230.1946 24.48669 230.6767 23.99843 231.1588 23.15686 231.6410 22.56346 232.1231 22.52112 232.6052 22.83231 233.0873 23.10216 233.5694 23.08095 234.0515 22.82712 234.5337 22.76755 235.0158 23.24049 235.4979 23.50720 235.9800 23.20009 236.4621 22.52039 236.9442 21.93083 237.4264 21.71216 237.9085 21.75049 238.3906 21.51114 238.8727 20.72624 239.3548 20.02403 239.8369 19.69788 240.3191 19.62283 240.8012 19.49460 241.2833 19.16145 241.7654 18.67770 242.2475 18.20796 242.7296 17.74005 243.2118 17.30034 243.6939 16.98332 244.1760 16.71855 244.6581 16.24014 245.1402 15.31139 245.6223 14.26737 246.1045 13.82353 246.5866 14.20840 247.0687 14.49469 247.5508 14.13628 248.0329 13.27762 248.5150 12.41978 248.9972 11.68581 249.4793 11.07957 249.9614 10.68651 250.4435 10.58572 250.9256 10.21867 251.4077 9.054428 251.8899 7.292099 252.3720 5.791412 252.8541 4.836731 253.3362 4.157440 253.8183 3.393616 254.3004 2.543320 254.7826 1.864212 255.2647 1.690216 255.7468 1.888733 256.2289 1.737869 256.7110 0.8648220 257.1931 5.7601999E-02 257.6753 0.3949430 258.1574 0.2352450 258.6395 0.1431730 259.1216 0.6993410 259.6037 1.717728 260.0858 2.131012 260.5680 1.617310 261.0501 0.7422790 261.5322 0.4505460 262.0143 1.738983 262.4964 2.461472 262.9785 1.815521 263.4607 9.4589002E-02 263.9428 0.9235380 264.4249 0.7530820 264.9070 0.5390630 265.3891 0.9475560 265.8712 1.722656 266.3534 2.343872 266.8355 2.485168 267.3176 2.233902 267.7997 1.942825 268.2818 1.553894 268.7639 1.216324 269.2461 1.132813 269.7282 1.098236 270.2103 0.8352970 270.6924 0.2250370 271.1745 0.7413020 271.6566 2.241287 272.1388 5.139374 272.6209 7.015594 273.1030 6.850433 273.5851 5.642700 274.0672 4.391693 274.5493 3.490021 275.0315 3.016785 275.5136 3.255096 275.9957 4.693527 276.4778 5.943344 276.9599 6.714691 277.4420 7.240784 277.9242 7.691071 278.4063 8.131470 278.8884 8.602768 279.3705 9.237411 279.8526 10.27061 280.3347 10.93839 280.8169 10.80893 281.2990 10.58054 281.7811 10.80840 282.2632 11.60983 282.7453 12.65366 283.2274 13.45932 283.7096 13.93675 284.1917 14.39064 284.6738 14.91486 285.1559 15.35799 285.6380 15.45233 286.1201 15.27074 286.6023 15.27084 287.0844 16.07401 287.5665 17.98634 288.0486 19.45381 288.5307 20.06941 289.0128 20.63484 289.4950 21.50845 289.9771 22.67484 290.4592 23.92157 290.9413 25.07701 291.4234 26.14236 291.9055 27.05913 292.3877 27.75143 292.8698 28.37723 293.3519 28.83990 293.8340 29.27393 294.3161 29.96899 294.7982 31.17122 295.2804 32.82251 295.7625 34.09802 296.2446 34.55602 296.7267 35.09961 297.2088 35.82332 297.6909 36.75314 298.1731 37.95177 298.6552 39.46359 299.1373 41.17453 299.6194 42.64386 300.1015 43.80791 300.5836 44.75708 301.0658 45.27582 301.5479 45.66827 302.0300 46.26836 302.5121 47.20334 302.9942 48.34604 303.4763 49.45116 303.9585 50.47221 304.4406 51.51244 304.9227 52.77136 305.4048 53.92790 305.8869 54.55786 306.3690 54.63763 306.8512 54.70035 307.3333 55.52951 307.8154 57.54645 308.2975 59.23294 308.7796 60.54472 309.2617 61.63641 309.7439 62.52698 310.2260 63.26433 310.7081 63.96500 311.1902 64.76016 311.6723 65.70386 312.1544 66.36699 312.6366 65.92360 313.1187 66.03989 313.6008 67.90042 314.0829 70.91544 314.5650 73.67259 315.0471 75.16818 315.5293 75.44514 316.0114 74.98110 316.4935 74.73228 316.9756 75.59985 317.4577 76.18403 317.9398 76.49549 318.4220 75.96882 318.9041 76.33219 319.3862 76.22134 319.8683 76.01057 320.3504 76.25933 320.8326 75.42277 321.3147 75.49509 321.7968 75.08723 322.2789 74.77686 322.7610 72.80774 323.2431 69.58524 323.7253 67.04582 324.2074 65.37592 324.6895 64.12292 325.1716 63.70218 325.6537 63.34198 326.1358 62.47972 326.6180 61.07457 327.1001 59.47208 327.5822 58.02269 328.0643 56.72885 328.5464 55.61319 329.0285 54.74446 329.5107 53.94547 329.9928 53.27489 330.4749 52.62300 330.9570 51.75055 331.4391 50.44789 331.9212 48.75427 332.4034 47.25163 332.8855 45.94882 333.3676 44.83165 333.8497 44.16939 334.3318 43.63081 334.8139 42.72270 335.2961 41.19954 335.7782 39.27460 336.2603 37.62456 336.7424 36.50291 337.2245 35.27956 337.7066 33.64534 338.1888 32.03735 338.6708 30.93599 339.1530 30.43082 339.6351 30.14211 340.1172 29.48679 340.5993 28.29857 341.0814 27.16386 341.5635 26.03036 342.0457 24.99065 342.5278 24.03589 343.0099 23.20821 343.4920 22.67844 343.9741 22.75491 344.4562 23.52179 344.9384 23.48994 345.4205 21.47272 345.9026 19.76895 346.3847 19.21072 346.8668 19.37123 347.3489 19.44176 347.8311 18.93550 348.3132 17.97748 348.7953 17.05138 349.2774 15.95267 349.7595 15.23120 350.2416 15.22473 350.7238 15.53174 351.2059 15.69504 351.6880 15.53798 352.1701 15.28300 352.6522 15.40431 353.1343 16.15295 353.6165 16.52100 354.0986 16.10788 354.5807 15.51076 355.0628 14.95201 355.5449 14.51765 356.0270 14.32208 356.5092 14.54814 356.9913 15.21570 357.4734 15.80963 357.9555 15.64005 358.4376 16.33369 358.9197 16.82782 359.4019 17.13319 359.8840 16.68426 360.3661 17.20929 360.8482 17.34401 361.3303 17.46271 361.8124 18.12484 362.2946 17.78565 362.7767 18.43916 363.2588 18.69638 363.7409 19.13498 364.2230 19.18083 364.7051 19.34799 365.1873 19.90805 365.6694 20.25055 366.1515 19.90947 366.6336 20.83656 367.1157 21.86337 367.5978 22.49757 368.0800 22.75328 368.5621 22.85982 369.0442 22.88185 369.5263 22.80785 370.0084 22.71992 370.4905 22.63503 370.9727 22.57846 371.4548 22.67671 371.9369 22.84198 372.4190 22.77087 372.9011 22.11742 373.3832 21.26138 373.8654 20.84097 374.3475 20.93031 374.8296 20.89163 375.3117 20.29272 375.7938 19.44322 376.2759 18.74336 376.7581 18.16765 377.2402 17.85251 377.7223 18.13803 378.2044 18.84044 378.6865 19.12094 379.1686 18.63293 379.6508 17.82814 380.1329 17.28171 380.6150 16.98944 381.0971 16.62492 381.5792 15.99348 382.0613 15.26973 382.5435 14.75716 383.0256 14.49017 383.5077 14.13850 383.9898 13.32237 384.4719 12.16054 384.9540 11.41158 385.4362 11.40724 385.9183 11.56403 386.4004 11.64928 386.8825 11.63101 387.3646 11.37776 387.8467 10.80946 388.3289 10.00975 388.8110 9.146988 389.2931 8.082336 389.7752 7.245728 390.2573 6.744461 390.7394 6.502899 391.2216 6.572159 391.7037 6.941132 392.1858 7.198242 392.6679 6.791031 393.1500 5.491562 393.6321 4.740723 394.1143 5.105713 394.5964 5.452179 395.0785 4.974670 395.5606 3.907211 396.0427 3.087524 396.5248 3.087891 397.0070 3.716873 397.4891 3.930984 397.9712 3.465424 398.4533 2.886948 398.9354 2.052734 399.4175 1.225220 399.8997 0.7114260 400.3818 0.5958710 400.8639 0.6697390 401.3460 0.6155850 401.8281 0.3566740 402.3102 0.1838840 402.7924 9.9716000E-02 403.2745 8.2092002E-02 403.7566 0.1437840 404.2387 0.2654720 404.7208 0.4110260 405.2029 0.5660400 405.6851 0.7182770 406.1672 0.7847600 406.6493 0.8494870 407.1314 0.6848600 407.6135 1.4465000E-02 408.0956 0.7884520 408.5778 1.302689 409.0599 1.374954 409.5420 1.219757 410.0241 1.142792 410.5062 1.165314 410.9883 1.146957 411.4705 0.9883730 411.9526 0.8501430 412.4347 0.8166500 412.9168 0.8857880 413.3989 1.019318 413.8810 1.251526 414.3632 1.532166 414.8453 1.660767 415.3274 1.596634 415.8095 1.479553 416.2916 1.361008 416.7737 1.242554 417.2559 1.092972 417.7380 0.8212740 418.2201 0.3280354 418.7022 0.7947605 419.1843 1.061967 419.6664 1.140376 420.1486 0.4645218 420.6307 0.7626433 421.1128 0.6704382 421.5949 0.5622283 422.0770 0.9974322 422.5591 0.4312827 423.0413 0.8578710 423.5234 0.8881756 424.0055 1.099848 424.4876 0.9187847 424.9697 0.8590245 425.4518 1.192127 425.9340 1.307701 426.4161 1.081427 426.8982 1.304628 427.3803 0.7247596 427.8624 0.8495960 428.3445 1.278482 428.8267 1.071956 429.3088 1.302339 429.7909 1.366321 430.2730 0.6740900 430.7551 1.296991 431.2372 1.351141 431.7194 0.8213080 432.2015 0.6893010 432.6836 0.2456970 433.1657 8.7035999E-02 433.6478 0.1009830 434.1299 0.1765750 434.6121 0.3818970 435.0942 0.4428560 435.5763 0.5137940 436.0584 0.6136630 436.5405 0.7375790 437.0226 0.9156650 437.5048 1.148254 437.9869 1.334045 438.4690 1.267792 438.9511 0.8067320 439.4332 0.5600740 439.9153 0.4859010 440.3975 0.6809390 440.8796 1.280975 441.3617 2.203049 441.8438 3.290543 442.3259 4.598907 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