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求助粉末Casio3的晶体结构;
以下是测得的PDF卡片信息,我是新手,求高人指点
PDF#73-1110: QM=Calculated; d=Calculated; I=Calculated
Wollastonite, 1A
Ca Si O3
Radiation=CuKa1 Lambda=1.54060 Filter=
Calibration= d-Cutoff=17.7 I/Ic(RIR)=0.87
Ref= Calculated from ICSD using POWD-12++ (1997)
Triclinic - (Unknown), P-1 (2) Z=6 mp=
Cell=7.94x7.32x7.07<90.03x95.37x103.43> Pearson=aP30 (?)
Density(c)=2.909 Density(m)=3.070 Mwt=116.16 Vol=397.82 F(30)=94.7(.0067,47)
Ref= Ito, T., Sadanaga, R., Takeuchi, Y., Tokonami, M.
Proc. Jpn. Acad., 45 913 (1969)
Strong Line: 2.98/X 3.32/4 3.09/3 3.52/3 1.83/2 3.84/2 2.48/2 2.18/2 2.31/2 2.19/1
FIZ=023567: At least one TF missing.
Specimen from Hokizawa, Japan.
See PDF 00-042-0547.
Pyroxenoid group.
Calc.
density unusual but tolerable.
See PDF 01-076-0186.
The Existence of Partial Mirrors in Wollastonite i15 (P1-) ABX3
d(A) I(f) I(v) h k l n^2 2-Theta Theta 1/(2d) 2pi/d
7.6870 11.7 4.5 1 0 0 11.502 5.751 0.0650 0.8174
7.1179 0.2 0.1 0 1 0 12.425 6.213 0.0702 0.8827
7.0371 1.3 0.6 0 0 1 12.568 6.284 0.0711 0.8929
5.9621 0.1 0.1 -1 1 0 14.846 7.423 0.0839 1.0539
5.4591 1.4 0.8 -1 0 1 16.223 8.111 0.0916 1.1510
5.0628 0.3 0.2 0 -1 1 17.502 8.751 0.0988 1.2410
4.9478 3.5 2.1 1 0 1 17.913 8.956 0.1011 1.2699
4.9478 3.5 2.1 0 1 1 17.913 8.956 0.1011 1.2699
4.7041 2.1 1.3 1 1 0 18.849 9.424 0.1063 1.3357
4.6788 4.2 2.7 -1 1 1 18.952 9.476 0.1069 1.3429
4.4294 1.8 1.2 1 -1 1 20.030 10.015 0.1129 1.4185
4.0521 10.3 7.6 -1 -1 1 21.917 10.958 0.1234 1.5506
3.8435 20.3 15.7 2 0 0 23.122 11.561 0.1301 1.6348
3.7696 5.4 4.3 -2 1 0 23.582 11.791 0.1326 1.6668
3.5186 28.6 24.2 0 0 2 25.291 12.646 0.1421 1.7857
3.5186 28.6 24.2 -2 0 1 25.291 12.646 0.1421 1.7857
3.4429 7.2 6.2 -2 1 1 25.856 12.928 0.1452 1.8249
3.3228 40.7 36.5 -1 0 2 26.808 13.404 0.1505 1.8909
3.2442 2.0 1.8 2 0 1 27.470 13.735 0.1541 1.9367
3.2061 2.4 2.2 0 -2 1 27.803 13.901 0.1560 1.9597
3.2061 2.4 2.2 -1 2 1 27.803 13.901 0.1560 1.9597
3.1834 5.8 5.4 0 -1 2 28.005 14.003 0.1571 1.9737
3.1066 11.5 11.0 -1 1 2 28.713 14.356 0.1609 2.0225
3.0887 28.7 27.7 2 1 0 28.883 14.441 0.1619 2.0343
3.0887 28.7 27.7 1 0 2 28.883 14.441 0.1619 2.0343
2.9811 100.0 100.0 1 2 0 29.949 14.975 0.1677 2.1077
2.9811 100.0 100.0 -2 2 0 29.949 14.975 0.1677 2.1077
2.9235 7.1 7.2 -1 -1 2 30.553 15.277 0.1710 2.1492
2.9235 7.1 7.2 -2 -1 1 30.553 15.277 0.1710 2.1492
2.8013 3.0 3.2 -1 -2 1 31.921 15.960 0.1785 2.2430
2.8013 3.0 3.2 -2 2 1 31.921 15.960 0.1785 2.2430
2.7449 1.0 1.1 2 1 1 32.595 16.297 0.1822 2.2891
2.7295 6.6 7.2 -2 0 2 32.783 16.392 0.1832 2.3019
2.7224 4.4 4.8 1 1 2 32.871 16.436 0.1837 2.3079
2.6848 1.2 1.3 -2 1 2 33.346 16.673 0.1862 2.3403
2.6848 1.2 1.3 1 2 1 33.346 16.673 0.1862 2.3403
2.6130 1.6 1.8 -3 1 0 34.290 17.145 0.1914 2.4046
2.5623 6.6 7.7 3 0 0 34.989 17.495 0.1951 2.4521
2.5314 4.1 4.8 -1 2 2 35.431 17.715 0.1975 2.4821
2.5314 4.1 4.8 0 -2 2 35.431 17.715 0.1975 2.4821
2.5247 2.4 2.8 -3 1 1 35.529 17.764 0.1980 2.4887
2.4766 16.9 20.3 0 2 2 36.242 18.121 0.2019 2.5371
2.4766 16.9 20.3 1 -2 2 36.242 18.121 0.2019 2.5371
2.4312 0.1 0.1 -1 3 0 36.942 18.471 0.2057 2.5844
2.4312 0.1 0.1 -2 -1 2 36.942 18.471 0.2057 2.5844
2.3808 1.6 2.0 3 -1 1 37.754 18.877 0.2100 2.6391
2.3726 1.1 1.4 0 3 0 37.889 18.944 0.2107 2.6482
2.3564 6.9 8.7 -3 2 0 38.159 19.080 0.2122 2.6664
2.3521 8.9 11.3 2 2 0 38.233 19.117 0.2126 2.6713
2.3457 7.4 9.4 0 0 3 38.341 19.170 0.2132 2.6786
2.3364 6.4 8.2 3 0 1 38.500 19.250 0.2140 2.6893
2.3364 6.4 8.2 -1 -2 2 38.500 19.250 0.2140 2.6893
2.3065 15.4 19.9 -1 3 1 39.019 19.510 0.2168 2.7242
2.3065 15.4 19.9 -1 0 3 39.019 19.510 0.2168 2.7242
2.2856 1.5 2.0 -3 2 1 39.391 19.695 0.2188 2.7491
2.2822 1.5 2.0 -2 -2 1 39.451 19.725 0.2191 2.7531
2.2641 0.2 0.3 0 -3 1 39.780 19.890 0.2208 2.7751
2.2432 0.8 1.1 0 -1 3 40.166 20.083 0.2229 2.8010
2.2286 0.2 0.3 2 1 2 40.442 20.221 0.2244 2.8194
2.2147 3.8 5.1 1 2 2 40.706 20.353 0.2258 2.8370
2.2147 3.8 5.1 2 -2 2 40.706 20.353 0.2258 2.8370
2.1867 12.3 16.8 3 -2 1 41.251 20.625 0.2287 2.8734
2.1867 12.3 16.8 1 0 3 41.251 20.625 0.2287 2.8734
2.1826 15.6 21.3 -2 3 1 41.331 20.666 0.2291 2.8787
2.1826 15.6 21.3 2 2 1 41.331 20.666 0.2291 2.8787
2.1733 5.3 7.3 -3 0 2 41.516 20.758 0.2301 2.8910
2.1427 0.1 0.1 1 -1 3 42.137 21.069 0.2333 2.9323
2.1382 0.2 0.3 2 -3 1 42.230 21.115 0.2338 2.9385
2.1313 0.1 0.1 1 3 0 42.374 21.187 0.2346 2.9481
2.0940 1.1 1.6 -2 0 3 43.167 21.583 0.2388 3.0006
2.0877 1.5 2.1 3 1 1 43.303 21.651 0.2395 3.0096
2.0695 0.7 1.0 -1 -3 1 43.704 21.852 0.2416 3.0361
2.0695 0.7 1.0 -2 1 3 43.704 21.852 0.2416 3.0361
2.0397 0.5 0.7 1 1 3 44.376 22.188 0.2451 3.0805
2.0279 4.9 7.2 -3 2 2 44.647 22.323 0.2466 3.0983
2.0279 4.9 7.2 -2 -2 2 44.647 22.323 0.2466 3.0983
2.0135 0.4 0.6 3 -1 2 44.984 22.492 0.2483 3.1205
2.0135 0.4 0.6 1 3 1 44.984 22.492 0.2483 3.1205
2.0075 0.3 0.4 -1 3 2 45.126 22.563 0.2491 3.1298
1.9824 4.0 6.0 3 0 2 45.730 22.865 0.2522 3.1695
1.9788 2.3 3.5 -1 2 3 45.817 22.908 0.2527 3.1752
1.9533 0.4 0.6 -2 -1 3 46.451 23.226 0.2560 3.2168
1.9466 0.8 1.2 0 3 2 46.621 23.311 0.2569 3.2279
1.9466 0.8 1.2 -4 1 1 46.621 23.311 0.2569 3.2279
1.9409 2.4 3.7 0 2 3 46.764 23.382 0.2576 3.2372
1.9409 2.4 3.7 -3 3 1 46.764 23.382 0.2576 3.2372
1.9217 3.8 5.9 4 0 0 47.259 23.630 0.2602 3.2695
1.9217 3.8 5.9 2 0 3 47.259 23.630 0.2602 3.2695
1.9010 0.4 0.6 -4 0 1 47.808 23.904 0.2630 3.3052
1.8947 1.4 2.2 3 -2 2 47.976 23.988 0.2639 3.3162
1.8947 1.4 2.2 -1 -2 3 47.976 23.988 0.2639 3.3162
1.8917 1.5 2.4 2 2 2 48.058 24.029 0.2643 3.3215
1.8848 3.4 5.4 3 -3 1 48.244 24.122 0.2653 3.3336
1.8848 3.4 5.4 -4 2 0 48.244 24.122 0.2653 3.3336
1.8817 3.8 6.0 3 2 0 48.330 24.165 0.2657 3.3392
1.8776 2.4 3.8 2 -3 2 48.442 24.221 0.2663 3.3465
1.8566 4.8 7.7 -3 -2 1 49.024 24.512 0.2693 3.3842
1.8566 4.8 7.7 4 -1 1 49.024 24.512 0.2693 3.3842
1.8300 20.9 34.0 -1 4 0 49.785 24.893 0.2732 3.4334
1.8300 20.9 34.0 -3 1 3 49.785 24.893 0.2732 3.4334
1.8101 2.0 3.3 4 0 1 50.371 25.186 0.2762 3.4712
1.8053 2.5 4.1 -2 -3 1 50.513 25.256 0.2770 3.4803
1.7957 4.8 8.0 1 2 3 50.804 25.402 0.2784 3.4991
1.7957 4.8 8.0 2 -2 3 50.804 25.402 0.2784 3.4991
1.7843 1.1 1.8 4 -2 1 51.151 25.576 0.2802 3.5214
1.7843 1.1 1.8 1 3 2 51.151 25.576 0.2802 3.5214
1.7813 1.3 2.2 3 2 1 51.243 25.621 0.2807 3.5273
1.7813 1.3 2.2 0 4 0 51.243 25.621 0.2807 3.5273
1.7730 2.0 3.4 1 -4 1 51.499 25.750 0.2820 3.5437
1.7730 2.0 3.4 -3 3 2 51.499 25.750 0.2820 3.5437
1.7593 8.3 14.1 0 0 4 51.932 25.966 0.2842 3.5715
1.7593 8.3 14.1 -4 0 2 51.932 25.966 0.2842 3.5715
1.7551 5.1 8.7 4 1 0 52.064 26.032 0.2849 3.5799
1.7520 3.6 6.1 -1 0 4 52.163 26.081 0.2854 3.5862
1.7270 11.7 20.2 -2 -2 3 52.977 26.488 0.2895 3.6382
1.7270 11.7 20.2 -3 2 3 52.977 26.488 0.2895 3.6382
1.7215 10.6 18.4 -4 2 2 53.161 26.580 0.2904 3.6499
1.7158 5.1 8.9 0 -1 4 53.349 26.675 0.2914 3.6619
1.7158 5.1 8.9 0 4 1 53.349 26.675 0.2914 3.6619
1.6988 1.5 2.6 0 1 4 53.927 26.964 0.2943 3.6986
1.6988 1.5 2.6 -4 3 0 53.927 26.964 0.2943 3.6986
1.6945 1.0 1.8 -1 3 3 54.077 27.038 0.2951 3.7081
1.6894 0.3 0.5 -1 -1 4 54.251 27.125 0.2960 3.7191
1.6894 0.3 0.5 3 -3 2 54.251 27.125 0.2960 3.7191
1.6828 0.8 1.4 1 -3 3 54.483 27.242 0.2971 3.7338
1.6789 1.2 2.1 -4 3 1 54.619 27.309 0.2978 3.7424
1.6789 1.2 2.1 1 0 4 54.619 27.309 0.2978 3.7424
1.6724 1.1 2.0 -2 -3 2 54.848 27.424 0.2990 3.7569
1.6724 1.1 2.0 3 -1 3 54.848 27.424 0.2990 3.7569
1.6667 0.6 1.1 4 1 1 55.053 27.527 0.3000 3.7699
1.6625 1.5 2.7 1 -1 4 55.204 27.602 0.3008 3.7794
1.6625 1.5 2.7 -2 0 4 55.204 27.602 0.3008 3.7794
1.6579 0.9 1.6 4 -1 2 55.372 27.686 0.3016 3.7899
1.6527 0.5 0.9 3 0 3 55.559 27.780 0.3025 3.8018
1.6527 0.5 0.9 -3 4 0 55.559 27.780 0.3025 3.8018
1.6493 0.7 1.3 0 3 3 55.685 27.843 0.3032 3.8097
1.6328 0.4 0.7 -4 -1 2 56.295 28.147 0.3062 3.8480
1.6240 2.6 4.8 1 -4 2 56.629 28.314 0.3079 3.8689
1.6240 2.6 4.8 -1 4 2 56.629 28.314 0.3079 3.8689
1.6160 0.6 1.1 -1 -3 3 56.936 28.468 0.3094 3.8882
1.6073 5.0 9.3 4 -2 2 57.272 28.636 0.3111 3.9092
1.6031 9.9 18.4 0 -4 2 57.437 28.718 0.3119 3.9195
1.6031 9.9 18.4 -2 4 2 57.437 28.718 0.3119 3.9195
1.5903 0.3 0.6 -1 2 4 57.942 28.971 0.3144 3.9510
1.5903 0.3 0.6 -2 -1 4 57.942 28.971 0.3144 3.9510
1.5870 0.3 0.6 2 3 2 58.072 29.036 0.3151 3.9591
1.5754 1.4 2.6 -5 1 1 58.544 29.272 0.3174 3.9884
1.5754 1.4 2.6 2 -4 2 58.544 29.272 0.3174 3.9884
1.5735 1.5 2.8 -4 3 2 58.621 29.311 0.3178 3.9932
1.5735 1.5 2.8 0 4 2 58.621 29.311 0.3178 3.9932
1.5680 1.0 1.9 3 3 0 58.844 29.422 0.3189 4.0070
1.5640 1.5 2.9 0 2 4 59.011 29.505 0.3197 4.0174
1.5640 1.5 2.9 1 -2 4 59.011 29.505 0.3197 4.0174
1.5596 0.7 1.3 -3 3 3 59.194 29.597 0.3206 4.0287
1.5534 1.9 3.6 -2 2 4 59.456 29.728 0.3219 4.0449
1.5534 1.9 3.6 -1 -2 4 59.456 29.728 0.3219 4.0449
1.5490 1.5 2.9 -5 2 0 59.638 29.819 0.3228 4.0562
1.5468 0.9 1.7 2 -1 4 59.733 29.867 0.3232 4.0621
1.5468 0.9 1.7 4 2 0 59.733 29.867 0.3232 4.0621
1.5413 1.7 3.3 -5 2 1 59.970 29.985 0.3244 4.0767
1.5413 1.7 3.3 1 3 3 59.970 29.985 0.3244 4.0767
1.5374 3.3 6.4 5 0 0 60.136 30.068 0.3252 4.0869
1.5321 2.1 4.1 -5 0 1 60.364 30.182 0.3263 4.1009
1.5321 2.1 4.1 -4 2 3 60.364 30.182 0.3263 4.1009
1.5203 2.9 5.7 -1 -4 2 60.884 30.442 0.3289 4.1329
1.5203 2.9 5.7 -3 0 4 60.884 30.442 0.3289 4.1329
1.5070 0.2 0.4 3 3 1 61.480 30.740 0.3318 4.1694
1.4905 1.1 2.2 -4 4 0 62.234 31.117 0.3355 4.2154
1.4905 1.1 2.2 4 -3 2 62.234 31.117 0.3355 4.2154
1.4879 1.4 2.8 2 4 0 62.358 31.179 0.3361 4.2230
1.4837 1.2 2.4 4 2 1 62.550 31.275 0.3370 4.2347
1.4796 4.8 9.7 2 -2 4 62.745 31.372 0.3379 4.2465
1.4783 4.8 9.7 1 2 4 62.809 31.404 0.3382 4.2504
1.4765 3.0 6.1 3 -3 3 62.894 31.447 0.3386 4.2556
1.4735 3.2 6.5 3 -4 2 63.034 31.517 0.3393 4.2641
1.4735 3.2 6.5 -3 -3 2 63.034 31.517 0.3393 4.2641
1.4656 1.7 3.5 -5 2 2 63.415 31.708 0.3412 4.2872
1.4640 1.9 3.9 -4 -2 2 63.491 31.745 0.3415 4.2918
1.4614 5.6 11.4 -5 0 2 63.618 31.809 0.3421 4.2995
1.4614 5.6 11.4 -2 -2 4 63.618 31.809 0.3421 4.2995
1.4497 0.2 0.4 -2 5 0 64.193 32.097 0.3449 4.3342
1.4465 0.3 0.6 -5 3 1 64.351 32.175 0.3457 4.3437
1.4465 0.3 0.6 4 -1 3 64.351 32.175 0.3457 4.3437
1.4433 0.8 1.7 -1 4 3 64.509 32.254 0.3464 4.3532
1.4433 0.8 1.7 1 -4 3 64.509 32.254 0.3464 4.3532
1.4393 0.5 1.0 2 4 1 64.711 32.356 0.3474 4.3654
1.4337 3.0 6.2 0 -4 3 64.998 32.499 0.3488 4.3826
1.4337 3.0 6.2 -2 4 3 64.998 32.499 0.3488 4.3826
1.4303 2.5 5.2 0 -3 4 65.171 32.585 0.3496 4.3930
1.4303 2.5 5.2 -1 3 4 65.171 32.585 0.3496 4.3930
1.4238 0.4 0.8 -2 5 1 65.506 32.753 0.3512 4.4131
1.4238 0.4 0.8 -4 3 3 65.506 32.753 0.3512 4.4131
1.4210 0.6 1.3 4 0 3 65.651 32.826 0.3519 4.4218
1.4210 0.6 1.3 1 -3 4 65.651 32.826 0.3519 4.4218
1.4162 0.3 0.6 2 -5 1 65.898 32.949 0.3530 4.4365
1.4145 0.3 0.6 4 -2 3 65.987 32.994 0.3535 4.4419
1.4145 0.3 0.6 -2 3 4 65.987 32.994 0.3535 4.4419
1.4118 0.2 0.4 3 2 3 66.134 33.067 0.3542 4.4506 |
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