ba.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.	0.102582	
10.1617	-9999.	0.107605	
10.3261	-9999.	0.112874	
10.4931	-9999.	0.118401	
10.6628	-9999.	0.124198	
10.8353	-9999.	0.130280	
11.0106	-9999.	0.136659	
11.1886	-9999.	0.143350	
11.3696	-9999.	0.150369	
11.5535	-9999.	0.157732	
11.7404	-9999.	0.165455	
11.9303	-9999.	0.173557	
12.1232	-9999.	0.183338	
12.3193	-9999.	0.194288	
12.5186	-9999.	0.205891	
12.7210	-9999.	0.218187	
12.9268	-9999.	0.231218	
13.1359	-9999.	0.247615	
13.3483	-9999.	0.265218	
13.5642	-9999.	0.284072	
13.7836	-9999.	0.304267	
14.0066	-9999.	0.362677	
14.2331	-9999.	0.420004	
14.4633	-9999.	0.474092	
14.6973	-9999.	0.533738	
14.9350	-9999.	0.599553	
15.1765	-9999.	0.666927	
15.4220	-9999.	0.730960	
15.6714	-9999.	0.693144	
15.9249	-9999.	0.654676	
16.1825	-9999.	0.627532	
16.4442	-9999.	0.743404	
16.7102	-9999.	1.51055	
16.9805	-9999.	2.31632	
17.2551	-9999.	5.82720	
17.5342	-9999.	9.18758	
17.8178	-9999.	11.0651	
18.1060	-9999.	12.1706	
18.3989	-9999.	13.3866	
18.6964	-9999.	16.2715	
18.9988	-9999.	20.8311	
19.3061	-9999.	25.5391	
19.6184	-9999.	26.1763	
19.9357	-9999.	26.8294	
20.2582	-9999.	26.9725	
20.5858	-9999.	26.6972	
20.9188	-9999.	26.1269	
21.2571	-9999.	24.8556	
21.6009	-9999.	23.6461	
21.9503	-9999.	22.4955	
22.3053	-9999.	21.4008	
22.6661	-9999.	20.3594	
23.0327	-9999.	19.3687	
23.4053	-9999.	18.4262	
23.7838	-9999.	17.5296	
24.1685	-9999.	16.6625	
24.5594	-9999.	15.8365	
24.9566	-9999.	15.0515	
25.3603	-9999.	14.3054	
25.7705	-9999.	13.5963	
26.1873	-9999.	12.9224	
26.6109	-9999.	12.2818	
27.0413	-9999.	11.6730	
27.4786	-9999.	11.0944	
27.9231	-9999.	10.5444	
28.3747	-9999.	10.0018	
28.8337	-9999.	9.47953	
29.3000	16.4471	8.98449	
29.7739	16.4118	8.51529	
30.2555	16.3610	8.07059	
30.7449	16.2972	7.64914	
31.2421	16.2223	7.24967	
31.7475	16.1385	6.87108	
32.2609	16.0473	6.51225	
32.7827	15.9507	6.17216	
33.3130	15.8511	5.84984	
33.8518	15.7525	5.54435	
34.3993	15.6642	5.25481	
34.9557	15.5952	4.93304	
35.5211	15.4733	4.60153	
36.0956	15.3260	4.29229	
36.6794	15.1632	4.00384	
37.2727	14.9892	3.73477	
37.8755	14.8063	3.48379	
38.4882	14.6162	3.24967	
39.1107	14.4192	3.03129	
39.7432	14.2124	2.82758	
40.3861	13.9867	2.65078	
41.0393	13.7788	2.50671	
41.7031	13.5820	2.37048	
42.3776	13.3893	2.24165	
43.0630	13.1988	2.11982	
43.7595	13.0094	2.00461	
44.4673	12.8201	1.89566	
45.1865	12.6304	1.79264	
45.9174	12.4395	1.69521	
46.6600	12.2468	1.60308	
47.4147	12.0515	1.51596	
48.1816	11.8526	1.43357	
48.9609	11.6481	1.35565	
49.7528	11.4328	1.28517	
50.5576	11.2181	1.23309	
51.3753	11.0025	1.18311	
52.2062	10.7750	1.13822	
53.0506	10.5511	1.11996	
53.9087	10.3328	1.10248	
54.7806	10.1173	1.09259	
55.6667	9.90343	1.08279	
56.5670	9.68751	1.07307	
57.4820	9.46682	1.06344	
58.4117	9.23752	1.05467	
59.3564	9.00202	1.05299	
60.3165	8.75803	1.05131	
61.2921	8.49452	1.05807	
62.2834	8.23364	1.08111	
63.2908	7.97118	1.10465	
64.3145	7.70083	1.12871	
65.3547	7.41884	1.15329	
66.4118	7.11976	1.18423	
67.4859	6.81304	1.22252	
68.5775	6.49324	1.26205	
69.6867	6.15469	1.30286	
70.8138	5.79502	1.35385	
71.9591	5.41993	1.41089	
73.1230	5.02291	1.47033	
74.3057	4.59965	1.53540	
75.5076	4.14695	1.60409	
76.7289	3.65522	1.67585	
77.9699	3.12021	1.76771	
79.2310	2.55199	1.87205	
80.5125	1.94112	1.98004	
81.8147	1.26884	2.08822	
83.1380	0.523413	2.20232	
84.4827	-0.303533	2.32265	
85.8491	-1.25651	2.40436	
87.2377	-2.42703	2.47714	
88.6487	-3.91150	2.62019	
90.0825	-6.30092	2.67983	
91.5395	-8.68491	4.95387	
93.0201	-7.44126	9.15779	
94.5246	-7.78417	3.46252	
96.0535	-12.8572	4.27233	
97.6071	-18.3425	5.81709	
99.1858	-25.3014	9.46539	
100.790	-32.3295	17.3378	
102.420	-36.7988	35.0848	
104.077	-31.1338	48.0307	
105.760	-16.7618	57.2602	
107.471	-4.90253	58.1327	
109.209	2.58636	56.7582	
110.975	7.60516	54.9013	
112.770	11.1029	54.0482	
114.594	14.0726	56.8675	
116.448	24.3891	59.2316	
118.331	33.0949	54.9399	
120.245	38.4962	49.1254	
122.190	41.6121	43.2060	
124.166	43.2132	38.2524	
126.175	44.2136	33.9584	
128.215	44.9841	30.1464	
130.289	45.2608	26.1964	
132.397	44.9648	22.7133	
134.538	44.2934	19.5972	
136.714	43.2137	16.9951	
138.925	42.2342	15.0150	
141.172	41.5073	13.1863	
143.456	40.6208	11.3566	
145.776	39.6145	9.78092	
148.134	38.5811	8.39900	
150.530	37.5278	7.20139	
152.964	36.4787	6.17454	
155.439	35.4563	5.29133	
157.953	34.4445	4.52320	
160.507	33.4428	3.88064	
163.103	32.4402	3.32555	
165.742	31.5095	3.00542	
168.422	30.6674	2.71610	
171.146	29.8982	2.48691	
173.915	29.1737	2.27878	
176.727	28.4485	2.11933	
179.586	27.7783	2.01565	
182.491	27.1356	1.95126	
185.442	26.5163	1.93172	
188.442	25.9294	1.95618	
191.489	25.4055	2.05346	
194.587	24.9470	2.15559	
197.734	24.5310	2.25890	
200.932	24.1441	2.36442	
204.182	23.7817	2.47486	
207.485	23.4388	2.59047	
210.840	23.1069	2.71217	
214.251	22.7953	2.86120	
217.716	22.5081	3.01842	
221.237	22.2424	3.18428	
224.816	21.9976	3.35926	
228.452	21.7713	3.53807	
232.147	21.5604	3.72516	
235.902	21.3654	3.92214	
239.717	21.1886	4.12954	
243.595	21.0323	4.34790	
247.535	20.9066	4.57454	
251.538	20.7944	4.78890	
255.607	20.6951	5.01330	
259.741	20.6137	5.24822	
263.942	20.5574	5.49414	
268.211	20.5506	5.75159	
272.549	20.5807	5.95964	
276.957	20.5977	6.14489	
281.437	20.6217	6.33590	
285.989	20.6661	6.50912	
290.615	20.7040	6.66816	
295.315	20.7385	6.83109	
300.092	20.7802	6.99799	
304.945	20.8328	7.16898	
309.878	20.9009	7.34414	
314.890	21.0096	7.52358	
319.983	21.1348	7.64774	
325.158	21.2399	7.75537	
330.418	21.3401	7.86453	
335.762	21.4441	7.97523	
341.192	21.5579	8.08748	
346.711	21.7159	8.20132	
352.319	21.8753	8.23661	
358.017	21.9984	8.25766	
363.808	22.1041	8.27877	
369.692	22.2001	8.29992	
375.672	22.2901	8.32114	
381.748	22.3825	8.33827	
387.922	22.4646	8.34540	
394.197	22.5363	8.35254	
400.573	22.6023	8.35969	
407.052	22.6634	8.36685	
413.635	22.7205	8.37400	
420.326	22.7743	8.38117	
427.124	22.8257	8.38835	
434.032	22.8802	8.39552	
441.052	22.9354	8.39010	
448.186	22.9773	8.37524	
455.435	23.0091	8.36041	
462.802	23.0333	8.34559	
470.287	23.0508	8.33081	
477.894	23.0620	8.31606	
485.623	23.0674	8.30132	
493.478	23.0676	8.28662	
501.459	23.0634	8.27194	
509.570	23.0562	8.25728	
517.812	23.0473	8.24266	
526.187	23.0779	8.21598	
534.698	23.0726	8.12164	
543.346	23.0178	8.02838	
552.134	22.9356	7.93619	
561.065	22.8277	7.84506	
570.139	22.6941	7.75498	
579.361	22.5340	7.66593	
588.732	22.3455	7.57790	
598.254	22.1161	7.49307	
607.930	21.8618	7.42815	
617.763	21.5839	7.36380	
627.755	21.2722	7.30001	
637.908	20.9212	7.23676	
648.226	20.5237	7.17406	
658.711	20.0871	7.10649	
669.365	19.5704	7.01580	
680.191	18.9535	6.92626	
691.193	18.2240	6.83786	
702.372	17.3616	6.74705	
713.733	16.3003	6.64215	
725.277	14.9607	6.53888	
737.008	13.2144	6.43722	
748.928	10.7898	6.33714	
761.042	6.99366	6.23862	
773.351	-1.23942	6.14162	
780.100	-36.0464	6.08973	
780.300	-36.0387	32.0919	
785.859	-2.48177	32.0024	
798.570	7.54594	31.8010	
811.486	12.2086	31.6009	
824.611	15.3487	31.4021	
837.949	17.7528	31.2046	
851.502	19.7210	31.0083	
865.274	21.4009	30.8132	
879.269	22.8765	30.6193	
893.491	24.2016	30.4267	
907.943	25.4196	30.2353	
922.628	26.5386	30.0149	
937.551	27.5674	29.7930	
952.715	28.5218	29.5728	
968.124	29.4164	29.3541	
983.783	30.2603	29.1371	
999.695	31.0607	28.9217	
1015.86	31.8235	28.7079	
1032.29	32.5537	28.4957	
1048.99	33.2555	28.2850	
1065.96	33.9328	28.0759	
1083.20	34.5928	27.8683	
1100.72	35.2364	27.6539	
1118.52	35.8555	27.4321	
1136.61	36.4535	27.2122	
1155.	37.0349	26.9940	
1173.68	37.6023	26.7776	
1192.66	38.1582	26.5629	
1211.95	38.7048	26.3499	
1231.55	39.2445	26.1386	
1251.47	39.7803	25.9291	
1271.72	40.3155	25.7211	
1292.29	40.8552	25.5149	
1313.19	41.4079	25.3103	
1334.43	41.9972	25.1074	
1356.01	42.6608	24.8140	
1377.94	43.2544	24.3966	
1400.23	43.7468	23.9862	
1422.88	44.2015	23.5827	
1445.89	44.6256	23.1860	
1469.28	45.0252	22.7960	
1493.04	45.4048	22.4125	
1517.19	45.7683	22.0355	
1541.73	46.1205	21.6648	
1566.67	46.4742	21.3003	
1592.01	46.8200	20.9032	
1617.76	47.1331	20.4947	
1643.92	47.4136	20.0941	
1670.51	47.6743	19.7014	
1697.53	47.9178	19.3164	
1724.99	48.1461	18.9389	
1752.89	48.3609	18.5687	
1781.24	48.5636	18.2059	
1810.05	48.7554	17.8500	
1839.32	48.9372	17.5012	
1869.07	49.1149	17.1580	
1899.30	49.2814	16.8133	
1930.02	49.4340	16.4754	
1961.24	49.5778	16.1444	
1992.96	49.7102	15.8199	
2025.20	49.8429	15.5102	
2057.95	49.9708	15.1902	
2091.24	50.0873	14.8756	
2125.06	50.1945	14.5658	
2159.43	50.2937	14.2614	
2194.36	50.3858	13.9618	
2229.85	50.4707	13.6668	
2265.92	50.5487	13.3770	
2302.57	50.6202	13.0919	
2339.81	50.6853	12.8117	
2377.66	50.7445	12.5365	
2416.11	50.7978	12.2656	
2455.19	50.8451	11.9996	
2494.90	50.8876	11.7387	
2535.26	50.9246	11.4817	
2576.26	50.9561	11.2295	
2617.93	50.9825	10.9817	
2660.27	51.0045	10.7388	
2703.30	51.0214	10.4995	
2747.03	51.0334	10.2650	
2791.46	51.0407	10.0347	
2836.61	51.0441	9.80897	
2882.49	51.0426	9.58613	
2929.11	51.0363	9.36838	
2976.48	51.0258	9.15433	
3024.63	51.0109	8.94429	
3073.55	50.9914	8.73803	
3123.26	50.9675	8.53562	
3173.78	50.9390	8.33696	
3225.11	50.9060	8.14208	
3277.27	50.8684	7.95075	
3330.28	50.8259	7.76298	
3384.15	50.7786	7.57878	
3438.88	50.7262	7.39806	
3494.50	50.6686	7.22064	
3551.02	50.6055	7.04664	
3608.46	50.5367	6.87590	
3666.82	50.4618	6.70833	
3726.13	50.3805	6.54405	
3786.40	50.2923	6.38282	
3847.64	50.1967	6.22461	
3909.87	50.0930	6.06941	
3973.11	49.9805	5.91715	
4037.38	49.8584	5.76780	
4102.68	49.7255	5.62134	
4169.03	49.5806	5.47759	
4236.46	49.4221	5.33659	
4304.98	49.2480	5.19832	
4374.62	49.0559	5.06265	
4445.37	48.8425	4.92952	
4517.27	48.6038	4.79903	
4590.33	48.3344	4.67103	
4664.58	48.0266	4.54529	
4740.03	47.6696	4.42211	
4816.69	47.2473	4.30125	
4894.60	46.7334	4.18269	
4973.77	46.0814	4.06638	
5054.21	45.1951	3.95224	
5135.96	43.8132	3.84030	
5219.03	40.4393	3.73058	
5246.90	26.8164	3.69486	
5247.10	26.8174	11.3018	
5303.44	42.1310	11.0891	
5389.22	44.1362	10.7771	
5476.39	44.8272	10.4740	
5564.97	44.6340	10.1793	
5623.50	37.6496	9.99166	
5623.70	37.6535	13.7185	
5654.98	44.4926	13.5917	
5746.44	46.5402	13.2315	
5839.39	47.4390	12.8809	
5933.83	47.7822	12.5394	
5988.70	44.8521	12.3476	
5988.90	44.8558	14.0776	
6029.81	48.2474	13.9432	
6127.33	49.4817	13.6314	
6226.44	50.2716	13.3239	
6327.15	50.8992	13.0205	
6429.48	51.4293	12.7216	
6533.48	51.8900	12.4269	
6639.15	52.2971	12.1367	
6746.54	52.6609	11.8513	
6855.65	52.9885	11.5704	
6966.54	53.2853	11.2943	
7079.22	53.5550	11.0228	
7193.72	53.8011	10.7562	
7310.07	54.0262	10.4945	
7428.31	54.2325	10.2375	
7548.45	54.4216	9.98525	
7670.54	54.5951	9.73791	
7794.61	54.7545	9.49546	
7920.68	54.9009	9.25799	
8048.79	55.0356	9.02501	
8178.98	55.1592	8.79689	
8311.26	55.2725	8.57343	
8445.69	55.3764	8.35485	
8582.29	55.4717	8.14094	
8721.11	55.5589	7.93140	
8862.16	55.6383	7.72653	
9005.50	55.7107	7.52636	
9151.16	55.7766	7.33034	
9299.17	55.8363	7.13886	
9449.58	55.8901	6.95164	
9602.42	55.9385	6.76883	
9757.73	55.9819	6.59020	
9915.55	56.0205	6.41580	
10075.9	56.0548	6.24546	
10238.9	56.0848	6.07915	
10404.5	56.1110	5.91682	
10572.8	56.1335	5.75838	
10743.8	56.1526	5.60379	
10917.6	56.1684	5.45295	
11094.2	56.1813	5.30582	
11273.6	56.1913	5.16231	
11455.9	56.1986	5.02236	
11641.2	56.2035	4.88591	
11829.5	56.2060	4.75287	
12020.8	56.2064	4.62320	
12215.3	56.2047	4.49681	
12412.8	56.2011	4.37364	
12613.6	56.1957	4.25362	
12817.6	56.1887	4.13669	
13025.0	56.1800	4.02278	
13235.6	56.1699	3.91182	
13449.7	56.1585	3.80376	
13667.2	56.1457	3.69851	
13888.3	56.1318	3.59604	
14112.9	56.1167	3.49626	
14341.2	56.1007	3.39912	
14573.1	56.0836	3.30456	
14808.9	56.0656	3.21252	
15048.4	56.0468	3.12293	
15291.8	56.0273	3.03575	
15539.1	56.0070	2.95091	
15790.4	55.9860	2.86836	
16045.8	55.9643	2.78805	
16305.4	55.9421	2.70991	
16569.1	55.9193	2.63389	
16837.1	55.8961	2.55995	
17109.4	55.8723	2.48804	
17386.1	55.8481	2.41809	
17667.4	55.8234	2.35006	
17953.1	55.7984	2.28391	
18243.5	55.7729	2.21959	
18538.6	55.7471	2.15704	
18838.4	55.7210	2.09623	
19143.1	55.6945	2.03711	
19452.7	55.6677	1.97964	
19767.4	55.6406	1.92377	
20087.1	55.6131	1.86946	
20412.0	55.5853	1.81667	
20742.1	55.5573	1.76536	
21077.6	55.5288	1.71549	
21418.5	55.5001	1.66703	
21765.0	55.4710	1.61993	
22117.0	55.4415	1.57417	
22474.7	55.4117	1.52970	
22838.2	55.3814	1.48648	
23207.6	55.3507	1.44450	
23583.0	55.3195	1.40371	
23964.4	55.2877	1.36407	
24352.0	55.2554	1.32557	
24745.9	55.2224	1.28817	
25146.2	55.1887	1.25183	
25552.9	55.1543	1.21653	
25966.2	55.1189	1.18224	
26386.1	55.0826	1.14894	
26812.9	55.0451	1.11659	
27246.6	55.0064	1.08517	
27687.3	54.9662	1.05465	
28135.1	54.9244	1.02501	
28590.2	54.8808	0.996231	
29052.6	54.8351	0.968276	
29522.5	54.7895	0.941128	
30000.0	54.7272	0.914765