mo.nff

利用matlab计算晶体结构的x射线衍射图谱

E(eV)	f1	f2
10.0000	-9999.	2.05457	
10.1617	-9999.	2.09151	
10.3261	-9999.	2.12912	
10.4931	-9999.	2.16740	
10.6628	-9999.	2.20637	
10.8353	-9999.	2.24604	
11.0106	-9999.	2.28643	
11.1886	-9999.	2.32754	
11.3696	-9999.	2.37202	
11.5535	-9999.	2.46593	
11.7404	-9999.	2.56357	
11.9303	-9999.	2.66508	
12.1232	-9999.	2.77060	
12.3193	-9999.	2.88030	
12.5186	-9999.	2.99435	
12.7210	-9999.	3.11291	
12.9268	-9999.	3.23616	
13.1359	-9999.	3.36203	
13.3483	-9999.	3.48762	
13.5642	-9999.	3.61789	
13.7836	-9999.	3.75304	
14.0066	-9999.	3.89324	
14.2331	-9999.	4.03867	
14.4633	-9999.	4.18954	
14.6973	-9999.	4.34604	
14.9350	-9999.	4.50839	
15.1765	-9999.	4.67121	
15.4220	-9999.	4.83613	
15.6714	-9999.	5.00686	
15.9249	-9999.	5.18363	
16.1825	-9999.	5.36663	
16.4442	-9999.	5.55610	
16.7102	-9999.	5.75226	
16.9805	-9999.	5.95257	
17.2551	-9999.	6.08877	
17.5342	-9999.	6.22809	
17.8178	-9999.	6.37059	
18.1060	-9999.	6.51635	
18.3989	-9999.	6.66545	
18.6964	-9999.	6.81797	
18.9988	-9999.	6.97397	
19.3061	-9999.	7.09743	
19.6184	-9999.	7.12882	
19.9357	-9999.	7.16034	
20.2582	-9999.	7.19201	
20.5858	-9999.	7.22381	
20.9188	-9999.	7.25576	
21.2571	-9999.	7.28785	
21.6009	-9999.	7.26216	
21.9503	-9999.	7.20440	
22.3053	-9999.	7.14711	
22.6661	-9999.	7.09027	
23.0327	-9999.	7.03388	
23.4053	-9999.	6.97794	
23.7838	-9999.	6.89925	
24.1685	-9999.	6.72686	
24.5594	-9999.	6.55877	
24.9566	-9999.	6.39489	
25.3603	-9999.	6.23510	
25.7705	-9999.	6.06197	
26.1873	-9999.	5.68613	
26.6109	-9999.	5.33358	
27.0413	-9999.	5.00289	
27.4786	-9999.	4.69271	
27.9231	-9999.	4.40128	
28.3747	-9999.	4.12778	
28.8337	-9999.	3.87127	
29.3000	7.14109	3.63071	
29.7739	6.72533	3.52811	
30.2555	6.41082	3.52740	
30.7449	6.12012	3.52668	
31.2421	5.81619	3.52597	
31.7475	5.44999	3.55299	
32.2609	5.10177	3.70055	
32.7827	4.78663	3.85423	
33.3130	4.46675	4.01430	
33.8518	4.08977	4.18441	
34.3993	3.70630	4.52399	
34.9557	3.37468	4.89112	
35.5211	3.05200	5.28805	
36.0956	2.73509	5.79166	
36.6794	2.48204	6.36260	
37.2727	2.28115	6.98982	
37.8755	2.13539	7.67888	
38.4882	2.05422	8.43889	
39.1107	2.06392	9.27839	
39.7432	2.19777	10.2014	
40.3861	2.52791	11.2163	
41.0393	3.26794	12.1550	
41.7031	3.96550	12.6741	
42.3776	4.59642	13.2155	
43.0630	5.25938	13.7799	
43.7595	6.06673	14.3685	
44.4673	7.15541	14.7247	
45.1865	8.06647	14.8731	
45.9174	8.95055	15.0230	
46.6600	9.98348	15.0570	
47.4147	10.8760	14.8457	
48.1816	11.6865	14.6375	
48.9609	12.5301	14.4321	
49.7528	13.3208	13.9515	
50.5576	13.9335	13.4612	
51.3753	14.4517	12.9882	
52.2062	14.9074	12.5318	
53.0506	15.3195	12.0914	
53.9087	15.7050	11.6666	
54.7806	16.1001	11.2566	
55.6667	16.5038	10.7337	
56.5670	16.7820	10.1849	
57.4820	16.9823	9.66409	
58.4117	17.1365	9.16995	
59.3564	17.2544	8.70107	
60.3165	17.3434	8.25615	
61.2921	17.4092	7.83399	
62.2834	17.4566	7.43342	
63.2908	17.4906	7.05334	
64.3145	17.5177	6.69268	
65.3547	17.5522	6.35047	
66.4118	17.6114	5.96761	
67.4859	17.5947	5.55969	
68.5775	17.5375	5.17967	
69.6867	17.4554	4.82561	
70.8138	17.3554	4.49577	
71.9591	17.2420	4.18845	
73.1230	17.1181	3.90216	
74.3057	16.9860	3.63543	
75.5076	16.8475	3.38693	
76.7289	16.7039	3.15543	
77.9699	16.5562	2.93974	
79.2310	16.4052	2.73880	
80.5125	16.2514	2.55158	
81.8147	16.0948	2.37718	
83.1380	15.9365	2.21690	
84.4827	15.7779	2.06768	
85.8491	15.6181	1.92850	
87.2377	15.4565	1.79868	
88.6487	15.2920	1.67761	
90.0825	15.1220	1.56468	
91.5395	14.9363	1.46227	
93.0201	14.7601	1.40457	
94.5246	14.5998	1.34915	
96.0535	14.4478	1.29591	
97.6071	14.2981	1.24477	
99.1858	14.1438	1.19777	
100.790	13.9945	1.16430	
102.420	13.8498	1.13176	
104.077	13.7032	1.10013	
105.760	13.5437	1.06939	
107.471	13.3816	1.07218	
109.209	13.2370	1.08333	
110.975	13.0987	1.09459	
112.770	12.9532	1.11384	
114.594	12.8221	1.14709	
116.448	12.7017	1.18133	
118.331	12.5868	1.21660	
120.245	12.4764	1.25291	
122.190	12.3698	1.29031	
124.166	12.2667	1.32867	
126.175	12.1658	1.36708	
128.215	12.0663	1.40659	
130.289	11.9683	1.44725	
132.397	11.8712	1.48908	
134.538	11.7749	1.53212	
136.714	11.6787	1.57641	
138.925	11.5811	1.62198	
141.172	11.4842	1.67427	
143.456	11.3900	1.72873	
145.776	11.2983	1.78495	
148.134	11.2085	1.84301	
150.530	11.1211	1.90295	
152.964	11.0376	1.96484	
155.439	10.9673	2.02402	
157.953	10.8910	2.06823	
160.507	10.8084	2.11340	
163.103	10.7276	2.15555	
165.742	10.6383	2.19107	
168.422	10.5431	2.22718	
171.146	10.4453	2.26003	
173.915	10.3376	2.28923	
176.727	10.2207	2.31881	
179.586	10.0957	2.34876	
182.491	9.96418	2.37833	
185.442	9.82172	2.40462	
188.442	9.66765	2.43120	
191.489	9.50593	2.45405	
194.587	9.32174	2.46796	
197.734	9.11382	2.48195	
200.932	8.87904	2.49599	
204.182	8.60621	2.51017	
207.485	8.29996	2.55152	
210.840	7.96033	2.60936	
214.251	7.58484	2.68466	
217.716	7.17890	2.78788	
221.237	6.72273	2.89582	
224.816	6.13684	3.05103	
228.452	5.46449	3.34436	
232.147	4.98261	3.86531	
235.902	4.38764	4.21362	
239.717	3.52232	4.62653	
243.595	2.71932	5.79938	
247.535	2.36222	7.04256	
251.538	2.24801	8.24308	
255.607	2.28168	9.40395	
259.741	2.52620	10.5460	
263.942	3.08531	11.6008	
268.211	3.58823	12.3003	
272.549	4.04744	12.9392	
276.957	4.53703	13.5292	
281.437	4.96971	14.0442	
285.989	5.40775	14.5843	
290.615	5.92008	15.0301	
295.315	6.32717	15.3597	
300.092	6.63434	15.6965	
304.945	6.87952	16.1973	
309.878	7.35390	16.7693	
314.890	7.82277	17.1064	
319.983	8.23404	17.4502	
325.158	8.61637	17.8009	
330.418	8.96402	18.1587	
335.762	9.35833	18.6361	
341.192	9.87946	19.0571	
346.711	10.3664	19.3710	
352.319	10.8277	19.6901	
358.017	11.2871	20.0145	
363.808	11.7541	20.3441	
369.692	12.2357	20.6793	
375.672	12.7393	21.0199	
381.748	13.2757	21.3661	
387.922	13.8763	21.7181	
394.197	14.5141	21.9808	
400.573	15.1508	22.2255	
407.052	15.8718	22.4729	
413.635	16.5789	22.5438	
420.326	17.2186	22.6054	
427.124	17.8387	22.6671	
434.032	18.4869	22.7290	
441.052	19.1433	22.7086	
448.186	19.7381	22.6427	
455.435	20.2941	22.5770	
462.802	20.8257	22.5115	
470.287	21.3387	22.4462	
477.894	21.8112	22.3811	
485.623	22.2891	22.3789	
493.478	22.8033	22.3835	
501.459	23.3452	22.3880	
509.570	23.9799	22.3913	
517.812	24.6022	22.2496	
526.187	25.1768	22.1088	
534.698	25.7472	21.9689	
543.346	26.3720	21.8299	
552.134	27.0518	21.5715	
561.065	27.6165	21.1880	
570.139	28.0979	20.8114	
579.361	28.5302	20.4415	
588.732	28.9301	20.0746	
598.254	29.2899	19.7025	
607.930	29.6135	19.3373	
617.763	29.9047	18.9789	
627.755	30.1654	18.6271	
637.908	30.3480	18.2925	
648.226	30.5404	18.0496	
658.711	30.7638	17.8099	
669.365	30.9905	17.5734	
680.191	31.2172	17.3400	
691.193	31.4428	17.1097	
702.372	31.6667	16.8825	
713.733	31.8890	16.6583	
725.277	32.1104	16.4371	
737.008	32.3318	16.2188	
748.928	32.5550	16.0035	
761.042	32.7821	15.7909	
773.351	33.0308	15.5813	
785.859	33.2961	15.3381	
798.570	33.5361	15.0640	
811.486	33.7736	14.7948	
824.611	34.0024	14.4768	
837.949	34.1897	14.1424	
851.502	34.3366	13.8157	
865.274	34.4592	13.4965	
879.269	34.5342	13.1848	
893.491	34.5958	12.9371	
907.943	34.6928	12.7188	
922.628	34.8570	12.5041	
937.551	34.9257	12.1555	
952.715	34.9654	11.8986	
968.124	34.9741	11.6472	
983.783	34.9950	11.4876	
999.695	35.0943	11.3353	
1015.86	35.2017	11.1200	
1032.29	35.2839	10.8972	
1048.99	35.3556	10.6752	
1065.96	35.4160	10.4537	
1083.20	35.4677	10.2369	
1100.72	35.5128	10.0246	
1118.52	35.5522	9.81674	
1136.61	35.5866	9.61307	
1155.	35.6163	9.41366	
1173.68	35.6418	9.21848	
1192.66	35.6635	9.02723	
1211.95	35.6816	8.83994	
1231.55	35.6972	8.65656	
1251.47	35.7102	8.47506	
1271.72	35.7200	8.29514	
1292.29	35.7240	8.11632	
1313.19	35.7228	7.94141	
1334.43	35.7173	7.77029	
1356.01	35.7079	7.60290	
1377.94	35.6948	7.43905	
1400.23	35.6781	7.27870	
1422.88	35.6580	7.12177	
1445.89	35.6350	6.96833	
1469.28	35.6096	6.81748	
1493.04	35.5820	6.66877	
1517.19	35.5493	6.51861	
1541.73	35.5106	6.37117	
1566.67	35.4662	6.22706	
1592.01	35.4169	6.08625	
1617.76	35.3628	5.94857	
1643.92	35.3036	5.81385	
1670.51	35.2393	5.68241	
1697.53	35.1700	5.55395	
1724.99	35.0963	5.42832	
1752.89	35.0166	5.30368	
1781.24	34.9297	5.18132	
1810.05	34.8355	5.06139	
1839.32	34.7331	4.94403	
1869.07	34.6223	4.82942	
1899.30	34.5023	4.71761	
1930.02	34.3724	4.60846	
1961.24	34.2314	4.50180	
1992.96	34.0775	4.39749	
2025.20	33.9109	4.29715	
2057.95	33.7284	4.19672	
2091.24	33.5261	4.09845	
2125.06	33.3013	4.00232	
2159.43	33.0497	3.90828	
2194.36	32.7655	3.81630	
2229.85	32.4408	3.72636	
2265.92	32.0646	3.63842	
2302.57	31.6204	3.55241	
2339.81	31.0823	3.46834	
2377.66	30.4063	3.38614	
2416.11	29.5065	3.30575	
2455.19	28.1757	3.22718	
2494.90	25.5859	3.15040	
2520.10	11.2625	3.10325	
2520.30	11.2642	11.2040	
2535.26	24.0587	11.1085	
2576.26	26.8680	10.8536	
2617.93	26.0422	10.6044	
2625.	20.8981	10.5631	
2625.20	20.9044	14.4992	
2660.27	29.0866	14.2329	
2703.30	30.8118	13.9174	
2747.03	31.8814	13.6091	
2791.46	32.5876	13.3074	
2836.61	32.8679	13.0125	
2865.40	30.1655	12.8303	
2865.60	30.1688	14.5800	
2882.49	33.2789	14.4619	
2929.11	34.6192	14.1444	
2976.48	35.4578	13.8306	
3024.63	36.1273	13.5216	
3073.55	36.6961	13.2160	
3123.26	37.1931	12.9152	
3173.78	37.6349	12.6192	
3225.11	38.0318	12.3278	
3277.27	38.3913	12.0411	
3330.28	38.7182	11.7583	
3384.15	39.0164	11.4808	
3438.88	39.2896	11.2081	
3494.50	39.5404	10.9403	
3551.02	39.7714	10.6777	
3608.46	39.9842	10.4195	
3666.82	40.1806	10.1664	
3726.13	40.3615	9.91778	
3786.40	40.5288	9.67476	
3847.64	40.6834	9.43567	
3909.87	40.8259	9.20177	
3973.11	40.9575	8.97269	
4037.38	41.0791	8.74823	
4102.68	41.1911	8.52848	
4169.03	41.2943	8.31339	
4236.46	41.3893	8.10299	
4304.98	41.4767	7.89703	
4374.62	41.5569	7.69556	
4445.37	41.6302	7.49855	
4517.27	41.6974	7.30603	
4590.33	41.7587	7.11781	
4664.58	41.8144	6.93374	
4740.03	41.8649	6.75402	
4816.69	41.9105	6.57842	
4894.60	41.9517	6.40683	
4973.77	41.9884	6.23928	
5054.21	42.0212	6.07566	
5135.96	42.0501	5.91595	
5219.03	42.0755	5.76013	
5303.44	42.0975	5.60790	
5389.22	42.1164	5.45944	
5476.39	42.1323	5.31458	
5564.97	42.1454	5.17329	
5654.98	42.1560	5.03544	
5746.44	42.1641	4.90096	
5839.39	42.1699	4.76981	
5933.83	42.1735	4.64199	
6029.81	42.1751	4.51733	
6127.33	42.1747	4.39583	
6226.44	42.1726	4.27741	
6327.15	42.1689	4.16196	
6429.48	42.1635	4.04943	
6533.48	42.1566	3.93987	
6639.15	42.1485	3.83309	
6746.54	42.1391	3.72901	
6855.65	42.1284	3.62760	
6966.54	42.1165	3.52884	
7079.22	42.1037	3.43266	
7193.72	42.0898	3.33892	
7310.07	42.0750	3.24771	
7428.31	42.0593	3.15890	
7548.45	42.0429	3.07241	
7670.54	42.0257	2.98818	
7794.61	42.0078	2.90621	
7920.68	41.9892	2.82643	
8048.79	41.9701	2.74870	
8178.98	41.9504	2.67295	
8311.26	41.9300	2.59939	
8445.69	41.9093	2.52772	
8582.29	41.8880	2.45790	
8721.11	41.8662	2.39011	
8862.16	41.8441	2.32416	
9005.50	41.8217	2.25988	
9151.16	41.7988	2.19726	
9299.17	41.7755	2.13639	
9449.58	41.7519	2.07724	
9602.42	41.7279	2.01966	
9757.73	41.7037	1.96363	
9915.55	41.6792	1.90914	
10075.9	41.6543	1.85612	
10238.9	41.6292	1.80455	
10404.5	41.6037	1.75438	
10572.8	41.5779	1.70558	
10743.8	41.5519	1.65812	
10917.6	41.5255	1.61196	
11094.2	41.4988	1.56706	
11273.6	41.4717	1.52340	
11455.9	41.4443	1.48093	
11641.2	41.4165	1.43963	
11829.5	41.3882	1.39947	
12020.8	41.3596	1.36041	
12215.3	41.3304	1.32243	
12412.8	41.3008	1.28549	
12613.6	41.2706	1.24958	
12817.6	41.2397	1.21465	
13025.0	41.2082	1.18069	
13235.6	41.1759	1.14767	
13449.7	41.1428	1.11556	
13667.2	41.1088	1.08434	
13888.3	41.0737	1.05399	
14112.9	41.0375	1.02447	
14341.2	41.0000	0.995771	
14573.1	40.9610	0.967867	
14808.9	40.9203	0.940736	
15048.4	40.8777	0.914356	
15291.8	40.8330	0.888708	
15539.1	40.7858	0.863772	
15790.4	40.7356	0.839525	
16045.8	40.6821	0.815952	
16305.4	40.6246	0.793031	
16569.1	40.5623	0.770747	
16837.1	40.4944	0.749079	
17109.4	40.4194	0.728013	
17386.1	40.3357	0.707531	
17667.4	40.2409	0.687616	
17953.1	40.1317	0.668253	
18243.5	40.0030	0.649426	
18538.6	39.8467	0.631122	
18838.4	39.6487	0.613324	
19143.1	39.3813	0.596019	
19452.7	38.9768	0.579192	
19767.4	38.1753	0.562831	
19999.4	30.4363	0.551223	
19999.6	30.4365	3.71537	
20087.1	37.2967	3.68993	
20412.0	38.9275	3.59790	
20742.1	39.5664	3.50767	
21077.6	39.9762	3.41921	
21418.5	40.2786	3.33253	
21765.0	40.5177	3.24761	
22117.0	40.7145	3.16445	
22474.7	40.8808	3.08304	
22838.2	41.0239	3.00335	
23207.6	41.1488	2.92538	
23583.0	41.2589	2.84910	
23964.4	41.3568	2.77450	
24352.0	41.4442	2.70156	
24745.9	41.5227	2.63027	
25146.2	41.5935	2.56058	
25552.9	41.6574	2.49250	
25966.2	41.7154	2.42599	
26386.1	41.7681	2.36102	
26812.9	41.8160	2.29759	
27246.6	41.8596	2.23565	
27687.3	41.8992	2.17520	
28135.1	41.9354	2.11620	
28590.2	41.9683	2.05863	
29052.6	41.9983	2.00246	
29522.5	42.0256	1.94767	
30000.0	42.0503	1.89423