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anuozhang869金虫 (正式写手)
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【求助】二氧化硅衍射峰已有2人参与
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| 大家帮帮忙,有谁知道二氧化硅晶体xrd时的衍射峰是在什么角度出现(2sita) |
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aerowonder
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2楼2009-11-25 22:32:21
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4楼2009-11-26 07:56:34
5楼2009-12-23 09:39:49
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6楼2009-12-23 11:05:22
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PDF#65-0466: QM=Calculated; d=Calculated; I=Calculated Quartz low, syn Si O2 Radiation=CuKa1 Lambda=1.54060 Filter= Calibration= d-Cutoff= I/Ic(RIR)=3.32 Ref= Calculated from NIST using POWD-12++ Hexagonal - (Unknown), P3221 (154) Z=3 mp= Cell=4.9141x5.406 Pearson=hP9 (O2 Si) Density(c)=2.647 Density(m)=3.56A Mwt=60.08 Vol=113.06 F(30)=999.9(.0001,30) Ref= G.A.Lager, J.D.Jorgensen & F.J.Rotella American Inst. of Phys., Conference Proceedings 75-77 (1982) Strong Line: 3.34/X 4.26/2 1.82/1 2.46/1 2.28/1 1.54/1 1.38/1 2.13/1 1.37/1 1.67/1 NOTE: N 26666 24780 No TF given for entry, B=1.0 assumed d(A) I(f) I(v) h k l n^2 2-Theta Theta 1/(2d) 2pi/d 4.2557 17.1 13.4 1 0 0 20.856 10.428 0.1175 1.4764 3.3439 100.0 100.0 1 0 1 26.636 13.318 0.1495 1.8790 2.4571 5.3 7.2 1 1 0 36.540 18.270 0.2035 2.5572 2.2817 4.7 6.9 0 1 2 39.461 19.730 0.2191 2.7538 2.2369 0.9 1.3 1 1 1 40.285 20.143 0.2235 2.8089 2.1279 3.7 5.8 2 0 0 42.446 21.223 0.2350 2.9528 1.9800 1.4 2.4 2 0 1 45.788 22.894 0.2525 3.1733 1.8181 12.0 22.1 1 1 2 50.132 25.066 0.2750 3.4558 1.8020 0.2 0.4 0 0 3 50.613 25.306 0.2775 3.4868 1.6719 2.2 4.4 0 2 2 54.866 27.433 0.2991 3.7580 1.6594 1.1 2.2 1 0 3 55.317 27.658 0.3013 3.7865 1.6085 0.2 0.4 2 1 0 57.224 28.612 0.3108 3.9062 1.5417 4.6 10.0 2 1 1 59.950 29.975 0.3243 4.0754 1.4531 1.1 2.5 1 1 3 64.024 32.012 0.3441 4.3240 1.4186 0.3 0.7 3 0 0 65.775 32.888 0.3525 4.4292 1.3823 2.7 6.5 1 2 2 67.732 33.866 0.3617 4.5455 1.3751 4.0 9.7 0 2 3 68.132 34.066 0.3636 4.5691 1.3721 3.4 8.3 0 3 1 68.302 34.151 0.3644 4.5792 1.2881 0.9 2.3 0 1 4 73.452 36.726 0.3882 4.8778 1.2561 0.6 1.6 0 3 2 75.647 37.824 0.3981 5.0021 1.2285 0.8 2.2 2 2 0 77.658 38.829 0.4070 5.1144 1.2000 1.6 4.5 1 2 3 79.868 39.934 0.4167 5.2360 1.1980 1.1 3.1 2 2 1 80.029 40.015 0.4174 5.2448 1.1842 0.8 2.3 1 1 4 81.155 40.577 0.4222 5.3059 1.1803 1.6 4.5 3 1 0 81.475 40.738 0.4236 5.3232 1.1532 1.0 2.9 1 3 1 83.822 41.911 0.4336 5.4487 1.1408 0.3 0.9 0 2 4 84.937 42.469 0.4383 5.5075 1.1184 0.2 0.6 2 2 2 87.057 43.529 0.4471 5.6179 1.1146 0.2 0.6 0 3 3 87.428 43.714 0.4486 5.6370 1.0817 1.1 3.4 1 3 2 90.813 45.407 0.4622 5.8087 1.0639 0.2 0.6 4 0 0 92.771 46.385 0.4700 5.9056 1.0479 0.5 1.6 1 0 5 94.625 47.313 0.4771 5.9959 1.0439 0.3 1.0 4 0 1 95.102 47.551 0.4790 6.0189 1.0347 1.1 3.6 2 1 4 96.218 48.109 0.4832 6.0722 1.0151 0.6 2.0 2 2 3 98.725 49.362 0.4926 6.1899 0.9896 0.3 1.0 1 1 5 102.221 51.110 0.5052 6.3491 0.9896 0.3 1.0 0 4 2 102.221 51.110 0.5052 6.3491 0.9874 0.4 1.4 3 1 3 102.545 51.273 0.5064 6.3635 0.9785 0.7 2.4 0 3 4 103.849 51.924 0.5110 6.4212 0.9763 0.7 2.4 3 2 0 104.175 52.088 0.5121 6.4355 0.9639 0.1 0.3 2 0 5 106.093 53.046 0.5187 6.5185 0.9608 1.1 3.8 2 3 1 106.589 53.294 0.5204 6.5396 0.9287 0.1 0.4 4 1 0 112.082 56.041 0.5384 6.7657 0.9183 0.8 2.9 3 2 2 114.036 57.018 0.5445 6.8424 0.9162 0.9 3.3 0 4 3 114.442 57.221 0.5458 6.8581 0.9153 0.7 2.6 4 1 1 114.616 57.308 0.5463 6.8648 0.9091 0.1 0.4 2 2 4 115.844 57.922 0.5500 6.9116 0.9010 0.1 0.4 0 0 6 117.501 58.751 0.5549 6.9736 0.8973 0.7 2.6 1 2 5 118.279 59.139 0.5572 7.0021 0.8890 0.6 2.3 3 1 4 120.095 60.048 0.5624 7.0676 0.8815 0.1 0.4 0 1 6 121.822 60.911 0.5672 7.1281 0.8783 0.3 1.1 1 4 2 122.571 61.286 0.5693 7.1539 0.8599 0.5 1.9 3 0 5 127.215 63.607 0.5815 7.3068 0.8511 0.1 0.4 5 0 0 129.644 64.822 0.5874 7.3820 0.8459 0.1 0.4 1 1 6 131.173 65.586 0.5911 7.4277 0.8408 0.1 0.4 0 5 1 132.736 66.368 0.5947 7.4730 0.8360 0.2 0.8 4 0 4 134.267 67.134 0.5981 7.5160 0.8297 0.6 2.4 2 0 6 136.373 68.186 0.6026 7.5730 0.8255 0.7 2.8 4 1 3 137.849 68.924 0.6057 7.6114 0.8190 0.2 0.8 3 3 0 140.269 70.135 0.6105 7.6716 0.8118 0.6 2.5 2 2 5 143.171 71.586 0.6159 7.7394 0.8118 0.6 2.5 5 0 2 143.171 71.586 0.6159 7.7394 0.8098 0.6 2.5 3 3 1 144.063 72.031 0.6175 7.7592 0.8043 0.5 2.1 4 2 0 146.572 73.286 0.6217 7.8124 |
7楼2009-12-25 09:28:01
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anuozhang869(金币+1,VIP+0): 12-25 16:43
anuozhang869(金币+1,VIP+0): 12-25 16:43
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PDF#46-1045: QM=Star(+); d=Diffractometer; I=Diffractometer Quartz, syn Si O2 (White) Radiation=CuKa1 Lambda=1.5405981 Filter=Ge Calibration=Internal(Si) d-Cutoff= I/Ic(RIR)=3.41 Ref= Kern, A., Eysel, W., Mineralogisch-Petrograph. Inst., Univ. Heidelberg, Germany. ICDD Grant-in-Aid (1993) Hexagonal - Powder Diffraction, P3221 (154) Z=3 mp= Cell=4.9134x5.4052 Pearson=hP9 (O2 Si) Density(c)=2.650 Density(m)=2.660 Mwt=60.08 Vol=113.01 F(30)=538.7(.0018,31) Ref= Z. Kristallogr., 198 177 (1992) Strong Line: 3.34/X 4.26/2 1.82/1 2.46/1 1.54/1 2.28/1 1.38/1 2.13/1 1.38/1 2.24/1 NOTE: Pattern taken at 23(1) C. Low temperature quartz. 2$GU determination based on profile fit method. To replace 33-1161. d(A) I(f) I(v) h k l n^2 2-Theta Theta 1/(2d) 2pi/d 4.2550 16.0 13.0 1 0 0 20.859 10.430 0.1175 1.4767 3.3435 100.0 100.0 1 0 1 26.639 13.320 0.1495 1.8792 2.4569 9.0 12.0 1 1 0 36.543 18.272 0.2035 2.5574 2.2815 8.0 12.0 1 0 2 39.464 19.732 0.2192 2.7540 2.2361 4.0 6.0 1 1 1 40.299 20.149 0.2236 2.8098 2.1277 6.0 9.0 2 0 0 42.449 21.224 0.2350 2.9530 1.9799 4.0 7.0 2 0 1 45.792 22.896 0.2525 3.1736 1.8180 13.0 24.0 1 1 2 50.138 25.069 0.2750 3.4562 1.8017 1.0 2.0 0 0 3 50.621 25.310 0.2775 3.4873 1.6717 4.0 8.0 2 0 2 54.873 27.437 0.2991 3.7585 1.6592 2.0 4.0 1 0 3 55.323 27.662 0.3014 3.7869 1.6083 1.0 2.0 2 1 0 57.234 28.617 0.3109 3.9068 1.5415 9.0 20.0 2 1 1 59.958 29.979 0.3244 4.0759 1.4529 2.0 5.0 1 1 3 64.034 32.017 0.3441 4.3246 1.4184 1.0 2.0 3 0 0 65.784 32.892 0.3525 4.4297 1.3821 6.0 15.0 2 1 2 67.742 33.871 0.3618 4.5461 1.3750 7.0 17.0 2 0 3 68.142 34.071 0.3636 4.5697 1.3719 5.0 12.0 3 0 1 68.316 34.158 0.3645 4.5800 1.2879 2.0 5.0 1 0 4 73.466 36.733 0.3882 4.8786 1.2559 3.0 8.0 3 0 2 75.658 37.829 0.3981 5.0027 1.2283 1.0 3.0 2 2 0 77.673 38.837 0.4071 5.1153 1.1998 2.0 6.0 2 1 3 79.882 39.941 0.4167 5.2368 1.1978 1.0 3.0 2 2 1 80.044 40.022 0.4174 5.2456 1.1840 2.0 6.0 1 1 4 81.171 40.585 0.4223 5.3068 1.1802 2.0 6.0 3 1 0 81.489 40.744 0.4237 5.3240 1.1530 1.0 3.0 3 1 1 83.838 41.919 0.4337 5.4495 1.1407 1.0 3.0 2 0 4 84.955 42.477 0.4383 5.5084 1.1145 1.0 3.0 3 0 3 87.437 43.718 0.4486 5.6374 1.0816 2.0 6.0 3 1 2 90.828 45.414 0.4623 5.8094 1.0638 1.0 3.0 4 0 0 92.785 46.393 0.4700 5.9064 1.0477 1.0 3.0 1 0 5 94.648 47.324 0.4772 5.9970 1.0438 1.0 3.0 4 0 1 95.115 47.558 0.4790 6.0195 1.0346 1.0 3.0 2 1 4 96.234 48.117 0.4833 6.0730 1.0149 1.0 3.0 2 2 3 98.747 49.374 0.4927 6.1909 0.9896 1.0 3.0 1 1 5 102.228 51.114 0.5053 6.3494 0.9872 1.0 3.0 3 1 3 102.563 51.282 0.5065 6.3644 0.9783 1.0 3.0 3 0 4 103.873 51.937 0.5111 6.4223 0.9762 1.0 3.0 3 2 0 104.199 52.100 0.5122 6.4365 0.9608 1.0 3.0 3 2 1 106.589 53.295 0.5204 6.5396 0.9285 1.0 4.0 4 1 0 112.110 56.055 0.5385 6.7668 0.9182 1.0 4.0 3 2 2 114.057 57.028 0.5446 6.8432 0.9161 2.0 7.0 4 0 3 114.462 57.231 0.5458 6.8589 0.9152 2.0 7.0 4 1 1 114.635 57.317 0.5463 6.8655 0.9089 1.0 4.0 2 2 4 115.881 57.940 0.5501 6.9130 0.9009 1.0 4.0 0 0 6 117.532 58.766 0.5550 6.9747 0.8972 1.0 4.0 2 1 5 118.308 59.154 0.5573 7.0032 0.8889 1.0 4.0 3 1 4 120.119 60.060 0.5625 7.0684 0.8814 1.0 4.0 1 0 6 121.848 60.924 0.5673 7.1290 0.8782 1.0 4.0 4 1 2 122.600 61.300 0.5694 7.1549 0.8598 1.0 4.0 3 0 5 127.245 63.623 0.5815 7.3078 0.8458 1.0 4.0 1 1 6 131.197 65.598 0.5911 7.4284 0.8407 1.0 4.0 5 0 1 132.750 66.375 0.5947 7.4733 0.8359 1.0 4.0 4 0 4 134.286 67.143 0.5981 7.5165 0.8296 1.0 4.0 2 0 6 136.417 68.208 0.6027 7.5741 0.8254 2.0 8.0 4 1 3 137.887 68.944 0.6058 7.6124 0.8189 1.0 4.0 3 3 0 140.310 70.155 0.6106 7.6726 0.8117 3.0 12.0 5 0 2 143.242 71.621 0.6160 7.7409 0.8097 1.0 4.0 3 3 1 144.110 72.055 0.6175 7.7602 |
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