fr.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.	0.504421E-01
10.1617	-9999.	0.605877E-01
10.3261	-9999.	0.727738E-01
10.4931	-9999.	0.893847E-01
10.6628	-9999.	0.117123	
10.8353	-9999.	0.153468	
11.0106	-9999.	0.201091	
11.1886	-9999.	0.263493	
11.3696	-9999.	0.403215	
11.5535	-9999.	0.637593	
11.7404	-9999.	1.00820	
11.9303	-9999.	1.59425	
12.1232	-9999.	2.49402	
12.3193	-9999.	3.36797	
12.5186	-9999.	4.54817	
12.7210	-9999.	6.14193	
12.9268	-9999.	6.92048	
13.1359	-9999.	7.24654	
13.3483	-9999.	7.58796	
13.5642	-9999.	7.88271	
13.7836	-9999.	8.17329	
14.0066	-9999.	8.47458	
14.2331	-9999.	8.76458	
14.4633	-9999.	8.92935	
14.6973	-9999.	9.09722	
14.9350	-9999.	9.26824	
15.1765	-9999.	9.44249	
15.4220	-9999.	9.62001	
15.6714	-9999.	9.74189	
15.9249	-9999.	9.83268	
16.1825	-9999.	9.92431	
16.4442	-9999.	10.0168	
16.7102	-9999.	10.1101	
16.9805	-9999.	10.2043	
17.2551	-9999.	10.3012	
17.5342	-9999.	10.4303	
17.8178	-9999.	10.5610	
18.1060	-9999.	10.6933	
18.3989	-9999.	10.8272	
18.6964	-9999.	10.9268	
18.9988	-9999.	10.9941	
19.3061	-9999.	11.0620	
19.6184	-9999.	11.1302	
19.9357	-9999.	11.1988	
20.2582	-9999.	11.2458	
20.5858	-9999.	11.2666	
20.9188	-9999.	11.2875	
21.2571	-9999.	11.3085	
21.6009	-9999.	11.3294	
21.9503	-9999.	11.3504	
22.3053	-9999.	11.2709	
22.6661	-9999.	11.1410	
23.0327	-9999.	11.0127	
23.4053	-9999.	10.8858	
23.7838	-9999.	10.7603	
24.1685	-9999.	10.6363	
24.5594	-9999.	10.3907	
24.9566	-9999.	10.1364	
25.3603	-9999.	9.88839	
25.7705	-9999.	9.64642	
26.1873	-9999.	9.41037	
26.6109	-9999.	9.18010	
27.0413	-9999.	8.95545	
27.4786	-9999.	8.73631	
27.9231	-9999.	8.36961	
28.3747	-9999.	8.01786	
28.8337	-9999.	7.68089	
29.3000	8.20151	7.35808	
29.7739	8.23441	7.04884	
30.2555	8.24724	6.75259	
30.7449	8.24326	6.46880	
31.2421	8.22521	6.19693	
31.7475	8.19569	5.93649	
32.2609	8.15753	5.68699	
32.7827	8.11852	5.44798	
33.3130	8.09379	5.21574	
33.8518	8.04513	4.92411	
34.3993	7.95254	4.64877	
34.9557	7.83510	4.38884	
35.5211	7.69907	4.14344	
36.0956	7.54766	3.91176	
36.6794	7.38289	3.69303	
37.2727	7.20616	3.48654	
37.8755	7.01849	3.29159	
38.4882	6.82067	3.10754	
39.1107	6.61351	2.93378	
39.7432	6.39861	2.76918	
40.3861	6.17244	2.60801	
41.0393	5.93336	2.45622	
41.7031	5.68251	2.31327	
42.3776	5.42014	2.17863	
43.0630	5.14591	2.05184	
43.7595	4.85917	1.93242	
44.4673	4.55899	1.81995	
45.1865	4.24399	1.71403	
45.9174	3.91179	1.61427	
46.6600	3.55697	1.52420	
47.4147	3.18975	1.45074	
48.1816	2.80584	1.38083	
48.9609	2.39436	1.32098	
49.7528	1.96878	1.27596	
50.5576	1.51783	1.23537	
51.3753	1.04624	1.21125	
52.2062	0.548511	1.18759	
53.0506	0.670946E-02	1.17509	
53.9087	-0.561414	1.17949	
54.7806	-1.17372	1.18619	
55.6667	-1.83459	1.20744	
56.5670	-2.56196	1.22906	
57.4820	-3.37803	1.28161	
58.4117	-4.28019	1.35180	
59.3564	-5.34996	1.44648	
60.3165	-6.58169	1.67507	
61.2921	-7.95180	2.20927	
62.2834	-9.30353	2.82885	
63.2908	-10.7475	3.62220	
64.3145	-12.2909	4.63807	
65.3547	-13.9294	5.93880	
66.4118	-15.6401	7.60433	
67.4859	-17.4392	9.73701	
68.5775	-19.3935	13.0209	
69.6867	-18.9220	16.9540	
70.8138	-18.4113	20.1567	
71.9591	-17.4802	23.1402	
73.1230	-15.6951	26.0543	
74.3057	-14.0159	27.7573	
75.5076	-12.4719	29.5716	
76.7289	-10.4841	31.2632	
77.9699	-8.74043	32.3030	
79.2310	-7.21406	33.3775	
80.5125	-5.65142	34.4876	
81.8147	-3.93848	35.4116	
83.1380	-2.35099	36.2088	
84.4827	-0.785691	37.0239	
85.8491	0.916632	37.8574	
87.2377	2.63936	38.3688	
88.6487	4.29564	38.8845	
90.0825	5.96767	39.4071	
91.5395	7.77770	39.8552	
93.0201	9.55404	40.1866	
94.5246	11.3939	40.5207	
96.0535	13.4668	40.8575	
97.6071	15.7734	40.7079	
99.1858	17.7984	40.2947	
100.790	19.7665	39.8856	
102.420	21.9487	39.4807	
104.077	24.4055	38.3227	
105.760	26.1375	36.6917	
107.471	27.4660	35.1300	
109.209	28.5434	33.6349	
110.975	29.4335	32.2034	
112.770	30.1739	30.8328	
114.594	30.7890	29.5205	
116.448	31.2958	28.2641	
118.331	31.7036	27.0612	
120.245	32.0015	25.9095	
122.190	32.2052	24.8924	
124.166	32.4282	23.9679	
126.175	32.6437	23.0778	
128.215	32.8428	22.2207	
130.289	33.0262	21.3954	
132.397	33.1984	20.6008	
134.538	33.3676	19.8357	
136.714	33.5520	19.0991	
138.925	33.8206	18.3897	
141.172	34.0583	17.4253	
143.456	34.1392	16.4744	
145.776	34.1129	15.5753	
148.134	34.0295	14.7254	
150.530	33.9034	13.9217	
152.964	33.7450	13.1620	
155.439	33.5652	12.4437	
157.953	33.3868	11.7474	
160.507	33.1577	11.0518	
163.103	32.8917	10.3974	
165.742	32.6006	9.78179	
168.422	32.2902	9.20258	
171.146	31.9647	8.65768	
173.915	31.6272	8.14504	
176.727	31.2834	7.66276	
179.586	30.9323	7.19660	
182.491	30.5613	6.75174	
185.442	30.1761	6.33440	
188.442	29.7797	5.94283	
191.489	29.3739	5.57548	
194.587	28.9708	5.22303	
197.734	28.5364	4.87132	
200.932	28.0645	4.54327	
204.182	27.5334	4.23733	
207.485	26.9664	4.08256	
210.840	26.4795	3.99129	
214.251	26.0727	3.88848	
217.716	25.6600	3.75850	
221.237	25.2354	3.63287	
224.816	24.8024	3.50930	
228.452	24.3491	3.38833	
232.147	23.8617	3.28584	
235.902	23.3420	3.20832	
239.717	22.8109	3.21316	
243.595	22.3185	3.24731	
247.535	21.8371	3.28183	
251.538	21.3433	3.31222	
255.607	20.7913	3.34244	
259.741	20.2516	3.52247	
263.942	19.7531	3.67600	
268.211	19.2610	3.83622	
272.549	18.7511	4.00466	
276.957	18.2392	4.21675	
281.437	17.7280	4.44009	
285.989	17.2042	4.67525	
290.615	16.6569	4.93749	
295.315	16.0981	5.23003	
300.092	15.5105	5.53991	
304.945	14.7850	5.93425	
309.878	14.1313	6.51216	
314.890	13.5958	7.14638	
319.983	13.0852	7.74686	
325.158	12.5592	8.39106	
330.418	12.0135	9.10047	
335.762	11.5074	9.93026	
341.192	11.0627	10.8357	
346.711	10.7325	11.8029	
352.319	10.4466	12.7834	
358.017	10.2398	13.8453	
363.808	10.1713	14.9043	
369.692	10.1183	15.9324	
375.672	10.1230	17.0314	
381.748	10.3144	18.2062	
387.922	10.6910	19.2109	
394.197	10.9882	20.0720	
400.573	11.2682	20.9717	
407.052	11.6032	21.9118	
413.635	12.1193	22.8152	
420.326	12.5619	23.5265	
427.124	12.9540	24.2599	
434.032	13.3424	25.0161	
441.052	13.7491	25.7960	
448.186	14.1936	26.6001	
455.435	14.7291	27.4040	
462.802	15.2640	28.1419	
470.287	15.8142	28.8996	
477.894	16.4128	29.6778	
485.623	17.1107	30.4769	
493.478	17.9839	31.1245	
501.459	18.7684	31.5948	
509.570	19.4516	32.0722	
517.812	20.1179	32.5568	
526.187	20.7795	33.0487	
534.698	21.4467	33.5481	
543.346	22.1514	34.0550	
552.134	22.8749	34.5069	
561.065	23.5618	34.9290	
570.139	24.2220	35.3562	
579.361	24.7993	35.7886	
588.732	25.2954	36.3997	
598.254	25.9975	37.2383	
607.930	26.9086	38.0962	
617.763	28.0481	38.9739	
627.755	29.7023	39.7894	
637.908	31.2485	39.8286	
648.226	32.6112	39.8678	
658.711	34.1322	39.8011	
669.365	35.4298	39.3794	
680.191	36.4527	38.9622	
691.193	37.3235	38.5495	
702.372	38.1307	38.2563	
713.733	38.9185	37.9709	
725.277	39.6908	37.6876	
737.008	40.4639	37.4065	
748.928	41.2133	37.0405	
761.042	41.8831	36.6436	
773.351	42.4664	36.2509	
785.859	42.9837	35.8804	
798.570	43.4592	35.5360	
811.486	43.8874	35.1995	
824.611	44.2473	34.8663	
837.949	44.4649	34.5362	
851.502	44.5618	34.4281	
865.274	44.6398	34.5656	
879.269	44.9663	34.9261	
893.491	45.4932	35.2900	
907.943	46.1977	35.6579	
922.628	47.2259	36.0296	
937.551	48.3156	35.8739	
952.715	49.3199	35.5848	
968.124	50.1449	35.1819	
983.783	50.8674	34.7837	
999.695	51.5308	34.3849	
1015.86	52.1576	33.9853	
1032.29	52.7043	33.5441	
1048.99	53.1798	33.1564	
1065.96	53.6578	32.8253	
1083.20	54.1379	32.4967	
1100.72	54.6110	32.1711	
1118.52	55.0763	31.8486	
1136.61	55.5343	31.5285	
1155.	55.9863	31.2112	
1173.68	56.4345	30.8968	
1192.66	56.8817	30.5849	
1211.95	57.3335	30.2759	
1231.55	57.8066	29.9695	
1251.47	58.2990	29.6183	
1271.72	58.7939	29.2201	
1292.29	59.2283	28.7649	
1313.19	59.6140	28.3156	
1334.43	59.9686	27.8729	
1356.01	60.2988	27.4366	
1377.94	60.6084	27.0065	
1400.23	60.9004	26.5826	
1422.88	61.1767	26.1646	
1445.89	61.4402	25.7530	
1469.28	61.6951	25.3439	
1493.04	61.9423	24.9356	
1517.19	62.1706	24.5136	
1541.73	62.3769	24.0956	
1566.67	62.5642	23.6843	
1592.01	62.7360	23.2790	
1617.76	62.8933	22.8801	
1643.92	63.0373	22.4873	
1670.51	63.1687	22.1008	
1697.53	63.2886	21.7206	
1724.99	63.4035	21.3460	
1752.89	63.5059	20.9654	
1781.24	63.5910	20.5871	
1810.05	63.6593	20.2120	
1839.32	63.7108	19.8430	
1869.07	63.7476	19.4805	
1899.30	63.7705	19.1242	
1930.02	63.7792	18.7736	
1961.24	63.7735	18.4293	
1992.96	63.7511	18.0909	
2025.20	63.7249	17.7664	
2057.95	63.6857	17.4314	
2091.24	63.6247	17.1003	
2125.06	63.5448	16.7728	
2159.43	63.4451	16.4500	
2194.36	63.3248	16.1310	
2229.85	63.1824	15.8168	
2265.92	63.0164	15.5068	
2302.57	62.8247	15.2013	
2339.81	62.6053	14.9002	
2377.66	62.3546	14.6024	
2416.11	62.0682	14.3086	
2455.19	61.7416	14.0198	
2494.90	61.3702	13.7357	
2535.26	60.9460	13.4550	
2576.26	60.4591	13.1785	
2617.93	59.8965	12.9062	
2660.27	59.2412	12.6381	
2703.30	58.4682	12.3739	
2747.03	57.5406	12.1139	
2791.46	56.4004	11.8581	
2836.61	54.9474	11.6062	
2882.49	52.9829	11.3581	
2929.11	50.0080	11.1141	
2976.48	43.7571	10.8739	
2999.80	14.7588	10.7590	
3000.	14.7598	27.3411	
3024.63	43.5016	26.9988	
3073.55	47.7068	26.3394	
3123.26	45.2210	25.6965	
3136.10	28.3985	25.5346	
3136.30	28.4101	36.8344	
3173.78	51.3460	36.1758	
3225.11	56.0636	35.3049	
3277.27	58.9599	34.4576	
3330.28	61.0702	33.6308	
3384.15	62.6955	32.8259	
3438.88	63.9602	32.0403	
3494.50	64.9104	31.2760	
3551.02	65.5147	30.5293	
3608.46	65.5359	29.8028	
3662.90	57.1638	29.1403	
3663.10	57.1679	33.7873	
3666.82	62.6257	33.7358	
3726.13	67.6779	32.9324	
3786.40	69.4397	32.1506	
3847.64	70.7093	31.3878	
3909.87	71.7279	30.6440	
3973.11	72.5770	29.9189	
4037.38	73.2932	29.2121	
4102.68	73.8913	28.5227	
4169.03	74.3660	27.8490	
4236.46	74.6756	27.1939	
4304.98	74.5157	26.5536	
4326.90	72.0670	26.3542	
4327.10	72.0685	27.8702	
4374.62	75.3603	27.4310	
4445.37	76.1956	26.7982	
4517.27	76.7376	26.1794	
4590.33	77.3433	25.5745	
4651.90	75.8060	25.0829	
4652.10	75.8133	26.1797	
4664.58	77.0697	26.0793	
4740.03	78.1543	25.4862	
4816.69	78.7891	24.9064	
4894.60	79.3065	24.3360	
4973.77	79.7544	23.7768	
5054.21	80.1531	23.2285	
5135.96	80.5125	22.6908	
5219.03	80.8390	22.1636	
5303.44	81.1369	21.6469	
5389.22	81.4093	21.1404	
5476.39	81.6587	20.6442	
5564.97	81.8874	20.1584	
5654.98	82.0973	19.6826	
5746.44	82.2897	19.2165	
5839.39	82.4657	18.7603	
5933.83	82.6265	18.3138	
6029.81	82.7736	17.8771	
6127.33	82.9076	17.4494	
6226.44	83.0291	17.0313	
6327.15	83.1393	16.6224	
6429.48	83.2387	16.2224	
6533.48	83.3279	15.8312	
6639.15	83.4075	15.4488	
6746.54	83.4782	15.0752	
6855.65	83.5403	14.7097	
6966.54	83.5943	14.3529	
7079.22	83.6410	14.0041	
7193.72	83.6805	13.6631	
7310.07	83.7129	13.3301	
7428.31	83.7389	13.0049	
7548.45	83.7589	12.6874	
7670.54	83.7733	12.3772	
7794.61	83.7820	12.0743	
7920.68	83.7854	11.7785	
8048.79	83.7837	11.4897	
8178.98	83.7773	11.2077	
8311.26	83.7664	10.9328	
8445.69	83.7512	10.6640	
8582.29	83.7317	10.4022	
8721.11	83.7084	10.1462	
8862.16	83.6811	9.89667	
9005.50	83.6502	9.65290	
9151.16	83.6157	9.41525	
9299.17	83.5780	9.18341	
9449.58	83.5369	8.95697	
9602.42	83.4931	8.73654	
9757.73	83.4476	8.52126	
9915.55	83.4018	8.31068	
10075.9	83.3538	8.09597	
10238.9	83.2965	7.88559	
10404.5	83.2338	7.67944	
10572.8	83.1655	7.47743	
10743.8	83.0916	7.27948	
10917.6	83.0118	7.08550	
11094.2	82.9259	6.89542	
11273.6	82.8335	6.70915	
11455.9	82.7340	6.52662	
11641.2	82.6268	6.34774	
11829.5	82.5112	6.17244	
12020.8	82.3862	6.00065	
12215.3	82.2506	5.83228	
12412.8	82.1030	5.66728	
12613.6	81.9414	5.50556	
12817.6	81.7633	5.34707	
13025.0	81.5655	5.19173	
13235.6	81.3437	5.03948	
13449.7	81.0914	4.89026	
13667.2	80.7995	4.74399	
13888.3	80.4537	4.60062	
14112.9	80.0295	4.46009	
14341.2	79.4808	4.32234	
14573.1	78.7013	4.18730	
14808.9	77.3355	4.05493	
15031.1	62.5967	3.93578	
15031.3	62.5970	9.97013	
15048.4	72.5037	9.95030	
15291.8	77.7719	9.67449	
15539.1	79.0260	9.40633	
15790.4	79.7286	9.14560	
16045.8	80.1794	8.89211	
16305.4	80.4733	8.64564	
16569.1	80.6477	8.40601	
16837.1	80.7135	8.17303	
17109.4	80.6586	7.94651	
17386.1	80.4305	7.72627	
17667.4	79.8216	7.51213	
17906.4	72.4356	7.33736	
17906.6	72.4357	10.3520	
17953.1	78.3486	10.3123	
18243.5	80.2277	10.0704	
18538.6	80.4351	9.83412	
18638.9	77.6556	9.75589	
18639.1	77.6561	11.1125	
18838.4	81.2916	10.9408	
19143.1	82.1175	10.6867	
19452.7	82.6729	10.4370	
19767.4	83.1094	10.1915	
20087.1	83.4726	9.95041	
20412.0	83.7840	9.71366	
20742.1	84.0559	9.48127	
21077.6	84.2964	9.25323	
21418.5	84.5108	9.02956	
21765.0	84.7032	8.81022	
22117.0	84.8766	8.59521	
22474.7	85.0335	8.38450	
22838.2	85.1758	8.17805	
23207.6	85.3050	7.97585	
23583.0	85.4225	7.77785	
23964.4	85.5295	7.58403	
24352.0	85.6268	7.39432	
24745.9	85.7154	7.20869	
25146.2	85.7959	7.02710	
25552.9	85.8690	6.84950	
25966.2	85.9353	6.67583	
26386.1	85.9954	6.50603	
26812.9	86.0496	6.34007	
27246.6	86.0985	6.17787	
27687.3	86.1423	6.01939	
28135.1	86.1815	5.86455	
28590.2	86.2164	5.71332	
29052.6	86.2472	5.56562	
29522.5	86.2743	5.42140	
30000.0	86.2979	5.28059