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En el diagrama de difracción de la muestra SUL1 hay un total de 38 máximos, situados en las siguientes posiciones [ver tabla en modo texto]:
|
Máximo |
Posición (2q) |
Posición (d) |
Intensidad (cuentas) |
Intensidad (%) |
Fondo continuo (cuentas) |
|
1 |
19.96917 |
4.4425 |
129.09427 |
8.3 |
42.43945 |
|
2 |
20.44688 |
4.3397 |
256.67606 |
16.5 |
42.31535 |
|
3 |
22.79716 |
3.8974 |
394.31909 |
25.4 |
33.97125 |
|
4 |
23.54616 |
3.7751 |
128.03735 |
8.2 |
36.65260 |
|
5 |
24.85575 |
3.5791 |
384.88351 |
24.8 |
42.62501 |
|
6 |
25.86088 |
3.4422 |
1054.29517 |
67.9 |
38.17892 |
|
7 |
26.84310 |
3.3184 |
760.68976 |
49.0 |
31.08418 |
|
8 |
28.75748 |
3.1017 |
1077.57117 |
69.4 |
44.30956 |
|
9 |
31.53529 |
2.8345 |
650.87256 |
41.9 |
34.51074 |
|
10 |
32.82612 |
2.7260 |
596.32849 |
38.4 |
39.70844 |
|
11 |
36.18061 |
2.4806 |
229.16330 |
14.8 |
22.03064 |
|
12 |
36.71589 |
2.4456 |
59.37804 |
3.8 |
25.76916 |
|
13 |
38.74074 |
2.3223 |
270.16473 |
17.4 |
25.62033 |
|
14 |
39.06074 |
2.3040 |
159.01097 |
10.2 |
26.34199 |
|
15 |
39.49416 |
2.2797 |
154.62837 |
10.0 |
27.76214 |
|
16 |
40.82458 |
2.2085 |
516.18420 |
33.2 |
34.46176 |
|
17 |
41.62241 |
2.1679 |
68.85428 |
4.4 |
43.19620 |
|
18 |
42.60305 |
2.1203 |
1553.03601 |
100.0 |
56.89230 |
|
19 |
42.92897 |
2.1049 |
1524.35217 |
98.2 |
58.95179 |
|
20 |
44.00606 |
2.0559 |
353.16159 |
22.7 |
43.69802 |
|
21 |
47.05467 |
1.9295 |
182.72237 |
11.8 |
23.85169 |
|
22 |
49.00077 |
1.8574 |
363.81421 |
23.4 |
23.99175 |
|
23 |
51.01842 |
1.7885 |
104.90271 |
6.8 |
23.46522 |
|
24 |
52.04931 |
1.7555 |
255.41473 |
16.4 |
36.48046 |
|
25 |
53.06137 |
1.7244 |
116.06342 |
7.5 |
40.82633 |
|
26 |
54.86568 |
1.6719 |
347.33783 |
22.4 |
39.30930 |
|
27 |
56.16016 |
1.6364 |
202.02075 |
13.0 |
69.30164 |
|
28 |
60.27357 |
1.5342 |
341.30536 |
22.0 |
27.80831 |
|
29 |
61.99141 |
1.4957 |
98.36031 |
6.3 |
37.16455 |
|
30 |
62.99296 |
1.4743 |
278.40500 |
17.9 |
41.64303 |
|
31 |
63.87962 |
1.4560 |
85.23152 |
5.5 |
27.94658 |
|
32 |
65.44176 |
1.4249 |
341.63055 |
22.0 |
66.54063 |
|
33 |
66.45099 |
1.4057 |
183.48341 |
11.8 |
73.78864 |
|
34 |
66.70731 |
1.4010 |
288.51682 |
18.6 |
63.29192 |
|
35 |
67.60999 |
1.3844 |
176.43556 |
11.4 |
43.41947 |
|
36 |
67.93738 |
1.3785 |
160.60022 |
10.3 |
47.61376 |
|
37 |
68.84882 |
1.3625 |
176.80775 |
11.4 |
53.81323 |
|
38 |
69.60027 |
1.3496 |
142.06476 |
9.1 |
9.18379 |
Para generar un fichero de entrada a los programas de asignación de índices de Miller a los máximos de difracción (DICVOL91 y TREOR90), guarda en tu ordenador y modifica adecuadamente los ficheros ejemplo ejemTRE.inp y ejemDIC.dic.
