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Kilor金虫 (著名写手)
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[交流]
求 Tb(NO3)3 的多晶衍射数据。
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如果带结晶水的也没有关系,Tb(NO3)3 -5H2O jade没有装。 谢谢 |
csxray
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Kilor(金币+5,VIP+0):谢谢 11-24 15:38
eeqeeq0002(金币+2,VIP+0):谢谢 参与 11-24 16:40
Kilor(金币+5,VIP+0):谢谢 11-24 15:38
eeqeeq0002(金币+2,VIP+0):谢谢 参与 11-24 16:40
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只找到这个: PDF#01-080-1318(RDB): QM=Blank(B); d=Calculated; I=Calculated Terbium Nitrate Hydrate Tb ( N O3 )3 ( H2 O )6 Radiation=CuK? Lambda=1.5406 Filter= Calibration= 2T=8.151-53.999 I/Ic(RIR)=1.05 Ref: Moret, E., Buenzli, J.-C.G., Schenk, K.J. Inorg. Chim. Acta, v178 p83 (1990) Triclinic - (Unknown), P-1 (2) Z=2 mp= CELL: 9.095 x 11.6 x 6.705 <91.14 x 110.79 x 70.14> P.S=aP62.00 Density(c)=2.435 Density(m)=2.41 Mwt=453.03 Vol=617.91 F(30)=153.8(0.005,39/0) Ref: Ibid. Strong Lines: 7.95/X 6.12/X 5.48/7 5.15/7 7.88/6 5.42/6 5.69/5 6.23/5 ANX: AB3X15. ICSD Collection Code: 69144. Calculated Pattern Original Remarks: ATOM H 1 +1. 24.00 Atoms not located in unit cell. Temperature Factor: ITF. Temperature of Data Collection: 295 K. Test from ICSD: Calc. density unusual but tolerable. Minor Warning: Site Occupancy factor>1.0 found. Incomplete determination of H atom positions in the structure. Significant Warning: ICSD Warning: The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct. Wyckoff Sequence: i19 (P1-). 2-Theta d(? I(f) ( h k l) Theta 1/(2d) 2pi/d n^2 8.151 10.8383 19.3 ( 0 1 0) 4.076 0.0461 0.5797 11.126 7.9461 100.0 ( 1 0 0) 5.563 0.0629 0.7907 11.213 7.8846 64.6 ( 1 1 0) 5.607 0.0634 0.7969 14.211 6.2272 52.3 ( 0 0 1) 7.106 0.0803 1.0090 14.451 6.1245 96.1 (-1 0 1) 7.225 0.0816 1.0259 15.412 5.7448 23.4 (-1-1 1) 7.706 0.0870 1.0937 15.566 5.6881 52.5 ( 0 1 1) 7.783 0.0879 1.1046 15.993 5.5372 24.7 (-1 1 0) 7.997 0.0903 1.1347 16.176 5.4751 65.8 ( 1 2 0) 8.088 0.0913 1.1476 16.344 5.4192 63.4 ( 0 2 0) 8.172 0.0923 1.1594 17.202 5.1507 65.8 ( 0-1 1) 8.601 0.0971 1.2199 17.734 4.9972 8.7 (-1 1 1) 8.867 0.1001 1.2573 20.029 4.4295 14.5 (-1-2 1) 10.015 0.1129 1.4185 20.516 4.3255 49.9 ( 1 1 1) 10.258 0.1156 1.4526 20.735 4.2803 9.9 (-2-1 1) 10.368 0.1168 1.4679 20.879 4.2511 11.1 ( 2 1 0) 10.440 0.1176 1.4780 21.118 4.2036 16.7 ( 1 0 1) 10.559 0.1189 1.4947 21.606 4.1097 14.8 (-2 0 1) 10.803 0.1217 1.5289 22.359 3.9730 1.9 ( 2 0 0) 11.179 0.1258 1.5815 22.535 3.9423 11.5 ( 2 2 0) 11.268 0.1268 1.5938 22.999 3.8638 39.0 ( 1 2 1) 11.500 0.1294 1.6262 22.999 3.8638 39.0 (-2-2 1) 11.500 0.1294 1.6262 23.596 3.7674 29.2 (-1 2 1) 11.798 0.1327 1.6678 24.646 3.6093 16.5 ( 1-1 1) 12.323 0.1385 1.7408 24.646 3.6093 16.5 ( 0 3 0) 12.323 0.1385 1.7408 25.305 3.5168 2.5 (-2 1 1) 12.652 0.1422 1.7866 26.478 3.3635 9.2 (-2 1 0) 13.239 0.1487 1.8681 26.478 3.3635 9.2 (-1-3 1) 13.239 0.1487 1.8681 26.779 3.3264 1.9 ( 2 3 0) 13.390 0.1503 1.8889 27.057 3.2929 24.8 ( 0 3 1) 13.528 0.1518 1.9081 27.676 3.2206 24.6 (-1-1 2) 13.838 0.1553 1.9509 27.676 3.2206 24.6 (-2-3 1) 13.838 0.1553 1.9509 27.941 3.1906 1.5 ( 1 3 1) 13.971 0.1567 1.9693 28.060 3.1774 4.5 (-1 1 2) 14.030 0.1574 1.9774 28.647 3.1136 5.6 ( 0 0 2) 14.324 0.1606 2.0180 28.965 3.0801 8.7 (-2-1 2) 14.483 0.1623 2.0399 29.280 3.0477 5.7 ( 2 1 1) 14.640 0.1641 2.0616 29.678 3.0077 0.4 (-3-1 1) 14.839 0.1662 2.0890 29.957 2.9803 2.1 ( 0-3 1) 14.979 0.1678 2.1082 30.052 2.9712 1.8 ( 2 2 1) 15.026 0.1683 2.1147 30.144 2.9623 2.2 ( 1-2 1) 15.072 0.1688 2.1211 30.241 2.9530 2.2 (-3-2 1) 15.121 0.1693 2.1277 30.587 2.9204 9.8 (-1 3 0) 15.293 0.1712 2.1515 30.672 2.9125 7.7 (-1 3 1) 15.336 0.1717 2.1573 30.818 2.8991 13.5 ( 1 4 0) 15.409 0.1725 2.1673 30.818 2.8991 13.5 ( 2 0 1) 15.409 0.1725 2.1673 30.890 2.8924 10.2 (-2 2 1) 15.445 0.1729 2.1723 30.972 2.8849 8.2 (-1-2 2) 15.486 0.1733 2.1779 31.111 2.8724 7.5 (-2-2 2) 15.556 0.1741 2.1874 31.403 2.8464 11.1 (-3 0 1) 15.701 0.1757 2.2074 31.403 2.8464 11.1 ( 0 2 2) 15.701 0.1757 2.2074 31.593 2.8296 13.9 (-2 1 2) 15.797 0.1767 2.2205 31.770 2.8143 13.1 (-1 2 2) 15.885 0.1777 2.2326 31.770 2.8143 13.1 ( 3 1 0) 15.885 0.1777 2.2326 32.309 2.7686 1.8 (-2 2 0) 16.154 0.1806 2.2695 32.685 2.7376 5.1 ( 2 4 0) 16.343 0.1826 2.2952 32.996 2.7125 10.4 ( 2 3 1) 16.498 0.1843 2.3164 32.996 2.7125 10.4 ( 0 4 0) 16.498 0.1843 2.3164 33.854 2.6457 1.3 (-2-4 1) 16.927 0.1890 2.3749 33.854 2.6457 1.3 ( 3 0 0) 16.927 0.1890 2.3749 33.916 2.6409 1.3 (-1-4 1) 16.958 0.1893 2.3791 34.086 2.6282 6.7 ( 3 3 0) 17.043 0.1902 2.3907 34.283 2.6136 15.7 ( 1 4 1) 17.141 0.1913 2.4041 34.283 2.6136 15.7 (-3-1 2) 17.141 0.1913 2.4041 34.416 2.6037 11.2 ( 2-1 1) 17.208 0.1920 2.4132 34.586 2.5913 21.6 ( 0 4 1) 17.293 0.1930 2.4247 34.586 2.5913 21.6 ( 1 0 2) 17.293 0.1930 2.4247 34.808 2.5753 5.1 ( 0-2 2) 17.404 0.1941 2.4398 35.182 2.5488 11.6 (-2-3 2) 17.591 0.1962 2.4651 35.182 2.5488 11.6 (-3-2 2) 17.591 0.1962 2.4651 35.823 2.5046 5.4 ( 0 3 2) 17.911 0.1996 2.5086 35.912 2.4986 6.8 (-2 2 2) 17.956 0.2001 2.5147 36.035 2.4904 6.9 (-1-3 2) 18.017 0.2008 2.5230 36.830 2.4384 7.4 ( 1-3 1) 18.415 0.2051 2.5767 37.048 2.4246 4.1 (-1 3 2) 18.524 0.2062 2.5914 37.316 2.4078 1.7 ( 1-1 2) 18.658 0.2077 2.6095 37.488 2.3971 12.1 (-3-4 1) 18.744 0.2086 2.6211 37.623 2.3889 16.5 (-2 3 1) 18.811 0.2093 2.6302 37.623 2.3889 16.5 ( 2 4 1) 18.811 0.2093 2.6302 37.983 2.3670 4.1 (-3-3 2) 18.992 0.2112 2.6545 38.103 2.3599 4.5 ( 3 4 0) 19.051 0.2119 2.6625 38.192 2.3545 5.2 ( 1 3 2) 19.096 0.2124 2.6686 38.409 2.3418 18.1 (-3 1 2) 19.204 0.2135 2.6831 38.409 2.3418 18.1 (-1 4 1) 19.204 0.2135 2.6831 38.709 2.3243 1.7 (-1 4 0) 19.354 0.2151 2.7033 39.190 2.2968 1.5 (-2 3 0) 19.595 0.2177 2.7356 39.335 2.2887 4.3 ( 3 2 1) 19.667 0.2185 2.7453 39.556 2.2764 4.3 ( 2-2 1) 19.778 0.2196 2.7601 39.671 2.2701 4.3 (-4-2 1) 19.835 0.2203 2.7678 39.671 2.2701 4.3 ( 3 1 1) 19.835 0.2203 2.7678 40.108 2.2464 5.0 (-4-1 1) 20.054 0.2226 2.7971 40.331 2.2345 3.0 (-3 2 1) 20.165 0.2238 2.8119 40.331 2.2345 3.0 ( 0-3 2) 20.165 0.2238 2.8119 40.618 2.2193 8.0 (-1 0 3) 20.309 0.2253 2.8311 40.706 2.2147 5.5 (-2-4 2) 20.353 0.2258 2.8370 40.853 2.2071 6.0 (-2 0 3) 20.426 0.2265 2.8468 40.853 2.2071 6.0 ( 3 3 1) 20.426 0.2265 2.8468 41.025 2.1982 11.1 (-2-5 1) 20.513 0.2275 2.8583 41.025 2.1982 11.1 (-4-3 1) 20.513 0.2275 2.8583 41.115 2.1937 6.3 (-2-1 3) 20.557 0.2279 2.8642 41.456 2.1764 5.0 ( 1 5 1) 20.728 0.2297 2.8870 41.456 2.1764 5.0 ( 2 1 2) 20.728 0.2297 2.8870 41.672 2.1656 22.1 ( 2 2 2) 20.836 0.2309 2.9014 41.672 2.1656 22.1 ( 3 0 1) 20.836 0.2309 2.9014 41.866 2.1560 12.7 (-1-5 1) 20.933 0.2319 2.9142 42.191 2.1401 4.5 (-4-2 2) 21.096 0.2336 2.9359 42.294 2.1352 6.6 (-1-4 2) 21.147 0.2342 2.9427 42.294 2.1352 6.6 (-4 0 1) 21.147 0.2342 2.9427 42.411 2.1296 5.6 (-2 1 3) 21.206 0.2348 2.9505 42.411 2.1296 5.6 (-3-4 2) 21.206 0.2348 2.9505 42.526 2.1241 5.7 ( 0 5 1) 21.263 0.2354 2.9581 42.526 2.1241 5.7 ( 4 2 0) 21.263 0.2354 2.9581 42.855 2.1086 3.7 ( 1 4 2) 21.427 0.2371 2.9799 42.999 2.1018 9.2 ( 2 0 2) 21.499 0.2379 2.9894 42.999 2.1018 9.2 (-3 2 0) 21.499 0.2379 2.9894 43.062 2.0989 6.2 (-2-2 3) 21.531 0.2382 2.9936 43.247 2.0903 4.2 (-3-5 1) 21.623 0.2392 3.0058 43.247 2.0903 4.2 ( 4 1 0) 21.623 0.2392 3.0058 43.402 2.0832 4.6 ( 0 1 3) 21.701 0.2400 3.0161 43.497 2.0789 6.9 (-1 4 2) 21.748 0.2405 3.0224 43.497 2.0789 6.9 ( 3 5 0) 21.748 0.2405 3.0224 43.585 2.0749 11.1 ( 2 5 1) 21.792 0.2410 3.0282 43.585 2.0749 11.1 ( 0 0 3) 21.792 0.2410 3.0282 43.738 2.0680 8.8 (-3-1 3) 21.869 0.2418 3.0383 43.738 2.0680 8.8 (-1 2 3) 21.869 0.2418 3.0383 44.032 2.0549 8.6 (-4-4 1) 22.016 0.2433 3.0577 44.032 2.0549 8.6 (-4 0 2) 22.016 0.2433 3.0577 44.286 2.0437 1.4 ( 1-4 1) 22.143 0.2447 3.0745 44.286 2.0437 1.4 (-3 0 3) 22.143 0.2447 3.0745 44.430 2.0374 4.7 (-1-2 3) 22.215 0.2454 3.0840 44.901 2.0171 5.6 ( 0 2 3) 22.451 0.2479 3.1150 45.110 2.0082 2.3 (-2 4 1) 22.555 0.2490 3.1288 45.381 1.9969 3.2 ( 0-1 3) 22.690 0.2504 3.1465 45.535 1.9905 2.7 (-2 2 3) 22.767 0.2512 3.1566 45.631 1.9865 4.4 ( 4 0 0) 22.815 0.2517 3.1629 45.837 1.9781 5.2 ( 0-5 1) 22.918 0.2528 3.1764 45.837 1.9781 5.2 ( 2-3 1) 22.918 0.2528 3.1764 46.019 1.9706 4.7 ( 4 4 0) 23.010 0.2537 3.1884 46.019 1.9706 4.7 (-4 1 1) 23.010 0.2537 3.1884 46.542 1.9497 6.6 (-2-3 3) 23.271 0.2564 3.2226 46.542 1.9497 6.6 (-3 1 3) 23.271 0.2564 3.2226 46.653 1.9453 6.6 (-1 5 1) 23.327 0.2570 3.2299 46.653 1.9453 6.6 (-3 3 1) 23.327 0.2570 3.2299 46.864 1.9371 6.7 ( 0-4 2) 23.432 0.2581 3.2436 46.997 1.9319 6.7 (-4-4 2) 23.499 0.2588 3.2524 47.124 1.9270 8.4 ( 2 4 2) 23.562 0.2595 3.2606 47.247 1.9223 10.6 ( 2 6 0) 23.624 0.2601 3.2687 47.247 1.9223 10.6 (-2-5 2) 23.624 0.2601 3.2687 47.439 1.9149 7.6 (-3-3 3) 23.720 0.2611 3.2812 47.439 1.9149 7.6 ( 1 6 0) 23.720 0.2611 3.2812 47.549 1.9107 5.6 (-1 3 3) 23.775 0.2617 3.2884 47.987 1.8943 3.1 (-3-5 2) 23.994 0.2639 3.3169 47.987 1.8943 3.1 ( 0 3 3) 23.994 0.2639 3.3169 48.274 1.8837 3.9 (-2 4 2) 24.137 0.2654 3.3355 48.274 1.8837 3.9 ( 0 5 2) 24.137 0.2654 3.3355 48.372 1.8801 4.2 ( 1 1 3) 24.186 0.2659 3.3419 48.573 1.8728 3.2 (-1-3 3) 24.287 0.2670 3.3549 48.573 1.8728 3.2 ( 3 5 1) 24.287 0.2670 3.3549 48.700 1.8683 3.1 (-2-6 1) 24.350 0.2676 3.3631 48.700 1.8683 3.1 ( 0-2 3) 24.350 0.2676 3.3631 49.015 1.8570 1.1 ( 1 2 3) 24.507 0.2693 3.3835 49.154 1.8521 4.7 (-4-1 3) 24.577 0.2700 3.3925 49.334 1.8457 3.0 (-3 3 0) 24.667 0.2709 3.4042 49.334 1.8457 3.0 ( 1 6 1) 24.667 0.2709 3.4042 49.419 1.8428 2.4 (-4 1 0) 24.709 0.2713 3.4097 49.419 1.8428 2.4 (-1-5 2) 24.709 0.2713 3.4097 49.992 1.8229 6.7 (-3-6 1) 24.996 0.2743 3.4468 49.992 1.8229 6.7 ( 4 5 0) 24.996 0.2743 3.4468 50.475 1.8066 3.9 ( 3 2 2) 25.237 0.2768 3.4778 50.475 1.8066 3.9 ( 2-2 2) 25.237 0.2768 3.4778 50.729 1.7982 3.9 (-5-3 1) 25.365 0.2781 3.4942 50.729 1.7982 3.9 (-1 5 2) 25.365 0.2781 3.4942 50.891 1.7928 2.6 ( 4 1 1) 25.446 0.2789 3.5046 50.959 1.7906 2.7 ( 3 1 2) 25.480 0.2792 3.5090 50.959 1.7906 2.7 ( 0 6 1) 25.480 0.2792 3.5090 51.133 1.7849 5.2 (-5-2 2) 25.566 0.2801 3.5201 51.133 1.7849 5.2 (-4-3 3) 25.566 0.2801 3.5201 51.357 1.7777 3.8 (-2-4 3) 25.679 0.2813 3.5345 51.447 1.7748 5.6 (-3-4 3) 25.723 0.2817 3.5403 51.447 1.7748 5.6 (-5-1 1) 25.723 0.2817 3.5403 51.647 1.7684 3.5 ( 1-1 3) 25.823 0.2827 3.5531 51.962 1.7584 2.4 (-5-1 2) 25.981 0.2844 3.5733 51.962 1.7584 2.4 (-4 2 2) 25.981 0.2844 3.5733 52.319 1.7472 2.5 ( 0 4 3) 26.160 0.2862 3.5961 52.319 1.7472 2.5 ( 1-5 1) 26.160 0.2862 3.5961 52.480 1.7422 2.1 ( 4 4 1) 26.240 0.2870 3.6064 52.662 1.7366 1.3 (-1 4 3) 26.331 0.2879 3.6180 52.662 1.7366 1.3 (-5-4 1) 26.331 0.2879 3.6180 52.952 1.7278 1.3 ( 2-4 1) 26.476 0.2894 3.6365 52.952 1.7278 1.3 ( 3 0 2) 26.476 0.2894 3.6365 53.149 1.7219 3.2 (-2 5 1) 26.575 0.2904 3.6491 53.149 1.7219 3.2 (-4 1 3) 26.575 0.2904 3.6491 53.299 1.7174 4.9 ( 0-3 3) 26.650 0.2911 3.6586 53.299 1.7174 4.9 ( 4 0 1) 26.650 0.2911 3.6586 53.832 1.7016 2.4 ( 3 4 2) 26.916 0.2938 3.6925 53.832 1.7016 2.4 ( 1-4 2) 26.916 0.2938 3.6925 53.999 1.6968 4.5 ( 5 2 0) 26.999 0.2947 3.7031 53.999 1.6968 4.5 (-4-6 1) 26.999 0.2947 3.7031 |
2楼2009-11-24 14:04:17
Kilor
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3楼2009-11-24 15:38:32
Kilor
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4楼2009-11-24 15:39:32
csxray
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5楼2009-11-24 19:16:37













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