yb.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.	0.217342	
10.1617	-9999.	0.218636	
10.3261	-9999.	0.219937	
10.4931	-9999.	0.221246	
10.6628	-9999.	0.222563	
10.8353	-9999.	0.223887	
11.0106	-9999.	0.225220	
11.1886	-9999.	0.226560	
11.3696	-9999.	0.228863	
11.5535	-9999.	0.233785	
11.7404	-9999.	0.238813	
11.9303	-9999.	0.243949	
12.1232	-9999.	0.249195	
12.3193	-9999.	0.255924	
12.5186	-9999.	0.264222	
12.7210	-9999.	0.272790	
12.9268	-9999.	0.281636	
13.1359	-9999.	0.290768	
13.3483	-9999.	0.300196	
13.5642	-9999.	0.309930	
13.7836	-9999.	0.319980	
14.0066	-9999.	0.330356	
14.2331	-9999.	0.340404	
14.4633	-9999.	0.350428	
14.6973	-9999.	0.360747	
14.9350	-9999.	0.371369	
15.1765	-9999.	0.382305	
15.4220	-9999.	0.393563	
15.6714	-9999.	0.405092	
15.9249	-9999.	0.416304	
16.1825	-9999.	0.427825	
16.4442	-9999.	0.439666	
16.7102	-9999.	0.451834	
16.9805	-9999.	0.464340	
17.2551	-9999.	0.477190	
17.5342	-9999.	0.490641	
17.8178	-9999.	0.504601	
18.1060	-9999.	0.518958	
18.3989	-9999.	0.533723	
18.6964	-9999.	0.548909	
18.9988	-9999.	0.564527	
19.3061	-9999.	0.580206	
19.6184	-9999.	0.592067	
19.9357	-9999.	0.604170	
20.2582	-9999.	0.616521	
20.5858	-9999.	0.629124	
20.9188	-9999.	0.641985	
21.2571	-9999.	0.655109	
21.6009	-9999.	0.671889	
21.9503	-9999.	0.691055	
22.3053	-9999.	0.710768	
22.6661	-9999.	0.731122	
23.0327	-9999.	0.753819	
23.4053	-9999.	0.777220	
23.7838	-9999.	0.801348	
24.1685	-9999.	0.858733	
24.5594	-9999.	0.942698	
24.9566	-9999.	1.04941	
25.3603	-9999.	1.19421	
25.7705	-9999.	1.35899	
26.1873	-9999.	1.87353	
26.6109	-9999.	2.26245	
27.0413	-9999.	3.32280	
27.4786	-9999.	4.88216	
27.9231	-9999.	6.60420	
28.3747	-9999.	8.21357	
28.8337	-9999.	9.79776	
29.3000	-7.21765	10.9300	
29.7739	-6.31581	11.4763	
30.2555	-5.62496	12.0459	
30.7449	-4.91262	12.6379	
31.2421	-4.17366	13.1291	
31.7475	-3.40908	13.6321	
32.2609	-2.57554	14.0106	
32.7827	-1.68872	14.3371	
33.3130	-0.753729	14.4480	
33.8518	0.553145E-01	14.4160	
34.3993	0.803437	14.3264	
34.9557	1.40798	14.0979	
35.5211	1.88638	13.9801	
36.0956	2.40036	13.8724	
36.6794	2.89561	13.7401	
37.2727	3.36949	13.5908	
37.8755	3.84796	13.4360	
38.4882	4.29509	13.1244	
39.1107	4.62161	12.8200	
39.7432	4.83909	12.5226	
40.3861	4.99178	12.3279	
41.0393	5.19168	12.1784	
41.7031	5.40153	12.0307	
42.3776	5.62132	11.8556	
43.0630	5.80016	11.6363	
43.7595	5.90350	11.4364	
44.4673	5.98688	11.2962	
45.1865	6.08046	11.1576	
45.9174	6.14512	11.0208	
46.6600	6.18050	10.9407	
47.4147	6.24312	10.8850	
48.1816	6.31779	10.8295	
48.9609	6.39083	10.7743	
49.7528	6.45032	10.7208	
50.5576	6.50755	10.7024	
51.3753	6.58577	10.6840	
52.2062	6.66766	10.6656	
53.0506	6.75706	10.6473	
53.9087	6.84959	10.6172	
54.7806	6.92873	10.5790	
55.6667	6.99692	10.5409	
56.5670	7.03893	10.5030	
57.4820	7.06138	10.5007	
58.4117	7.11139	10.5323	
59.3564	7.18152	10.5639	
60.3165	7.27755	10.5956	
61.2921	7.38628	10.5865	
62.2834	7.46321	10.5709	
63.2908	7.52990	10.5553	
64.3145	7.58340	10.5473	
65.3547	7.63544	10.5515	
66.4118	7.69063	10.5558	
67.4859	7.74192	10.5571	
68.5775	7.78038	10.5515	
69.6867	7.79514	10.5459	
70.8138	7.74345	10.5410	
71.9591	7.68596	10.7236	
73.1230	7.76202	10.9094	
74.3057	7.92332	11.0983	
75.5076	8.19139	11.1446	
76.7289	8.37015	11.0890	
77.9699	8.48327	11.0336	
79.2310	8.56571	10.9786	
80.5125	8.62044	10.9238	
81.8147	8.64233	10.8693	
83.1380	8.62841	10.8541	
84.4827	8.62358	10.8470	
85.8491	8.59253	10.8399	
87.2377	8.51996	10.8328	
88.6487	8.42516	10.9606	
90.0825	8.39519	11.0952	
91.5395	8.38922	11.2315	
93.0201	8.39842	11.3695	
94.5246	8.41879	11.5092	
96.0535	8.44813	11.6505	
97.6071	8.48497	11.7936	
99.1858	8.52842	11.9385	
100.790	8.57769	12.0852	
102.420	8.63234	12.2336	
104.077	8.69192	12.3839	
105.760	8.75617	12.5360	
107.471	8.82482	12.6900	
109.209	8.89772	12.8459	
110.975	8.97468	13.0037	
112.770	9.05562	13.1634	
114.594	9.14029	13.3251	
116.448	9.22855	13.4888	
118.331	9.32050	13.6557	
120.245	9.41705	13.8248	
122.190	9.51780	13.9960	
124.166	9.62275	14.1693	
126.175	9.73187	14.3448	
128.215	9.84527	14.5224	
130.289	9.96298	14.7022	
132.397	10.0852	14.8842	
134.538	10.2118	15.0685	
136.714	10.3433	15.2551	
138.925	10.4796	15.4440	
141.172	10.6210	15.6353	
143.456	10.7677	15.8289	
145.776	10.9201	16.0248	
148.134	11.0784	16.2233	
150.530	11.2433	16.4242	
152.964	11.4150	16.6275	
155.439	11.5945	16.8334	
157.953	11.7827	17.0419	
160.507	11.9812	17.2529	
163.103	12.1935	17.4665	
165.742	12.4270	17.6828	
168.422	12.6882	17.8602	
171.146	12.9249	18.0227	
173.915	13.1558	18.1867	
176.727	13.3855	18.3522	
179.586	13.6160	18.5192	
182.491	13.8488	18.6877	
185.442	14.0848	18.8577	
188.442	14.3246	19.0293	
191.489	14.5691	19.2025	
194.587	14.8190	19.3772	
197.734	15.0749	19.5535	
200.932	15.3379	19.7314	
204.182	15.6089	19.9110	
207.485	15.8892	20.0921	
210.840	16.1803	20.2750	
214.251	16.4846	20.4595	
217.716	16.8054	20.6456	
221.237	17.1478	20.8335	
224.816	17.5435	21.0230	
228.452	18.0216	21.1229	
232.147	18.4073	21.1519	
235.902	18.7589	21.1810	
239.717	19.0935	21.2101	
243.595	19.4158	21.2393	
247.535	19.7287	21.2685	
251.538	20.0340	21.2978	
255.607	20.3328	21.3270	
259.741	20.6256	21.3564	
263.942	20.9119	21.3857	
268.211	21.1898	21.4151	
272.549	21.4597	21.4598	
276.957	21.7381	21.5097	
281.437	22.0196	21.5597	
285.989	22.3031	21.6099	
290.615	22.5881	21.6601	
295.315	22.8748	21.7105	
300.092	23.1632	21.7610	
304.945	23.4536	21.8116	
309.878	23.7462	21.8623	
314.890	24.0415	21.9131	
319.983	24.3398	21.9641	
325.158	24.6417	22.0151	
330.418	24.9480	22.0663	
335.762	25.2594	22.1176	
341.192	25.5775	22.1691	
346.711	25.9044	22.2206	
352.319	26.2472	22.2723	
358.017	26.6204	22.3241	
363.808	26.9992	22.3006	
369.692	27.3455	22.2717	
375.672	27.6781	22.2430	
381.748	28.0027	22.2142	
387.922	28.3221	22.1855	
394.197	28.6379	22.1568	
400.573	28.9511	22.1281	
407.052	29.2629	22.0995	
413.635	29.5740	22.0709	
420.326	29.8854	22.0424	
427.124	30.1982	22.0139	
434.032	30.5136	21.9854	
441.052	30.8339	21.9570	
448.186	31.1636	21.9286	
455.435	31.5177	21.8919	
462.802	31.8616	21.8047	
470.287	32.1843	21.7178	
477.894	32.4957	21.6313	
485.623	32.8007	21.5451	
493.478	33.1013	21.4592	
501.459	33.3987	21.3737	
509.570	33.6941	21.2886	
517.812	33.9885	21.2037	
526.187	34.2831	21.1193	
534.698	34.5792	21.0351	
543.346	34.8785	20.9513	
552.134	35.1838	20.8678	
561.065	35.5003	20.7847	
570.139	35.8462	20.7019	
579.361	36.2174	20.5444	
588.732	36.5404	20.3594	
598.254	36.8341	20.1750	
607.930	37.1142	19.9921	
617.763	37.3859	19.8111	
627.755	37.6578	19.6303	
637.908	37.9265	19.4338	
648.226	38.1901	19.2142	
658.711	38.4167	18.9808	
669.365	38.6116	18.7499	
680.191	38.7715	18.5536	
691.193	38.9505	18.3836	
702.372	39.1502	18.2197	
713.733	39.3658	18.0278	
725.277	39.5555	17.8177	
737.008	39.7305	17.6101	
748.928	39.8964	17.4047	
761.042	40.0568	17.2010	
773.351	40.2134	16.9954	
785.859	40.3687	16.7784	
798.570	40.5027	16.5529	
811.486	40.6218	16.3299	
824.611	40.7295	16.1099	
837.949	40.8281	15.8926	
851.502	40.9176	15.6745	
865.274	40.9986	15.4554	
879.269	41.0655	15.2358	
893.491	41.1208	15.0189	
907.943	41.1660	14.8049	
922.628	41.2038	14.5939	
937.551	41.2308	14.3768	
952.715	41.2449	14.1605	
968.124	41.2441	13.9455	
983.783	41.2307	13.7332	
999.695	41.2067	13.5224	
1015.86	41.1727	13.3129	
1032.29	41.1219	13.0917	
1048.99	41.0514	12.8710	
1065.96	40.9572	12.6508	
1083.20	40.8412	12.4341	
1100.72	40.7036	12.2208	
1118.52	40.5430	12.0108	
1136.61	40.3582	11.8042	
1155.	40.1476	11.6010	
1173.68	39.9086	11.4011	
1192.66	39.6382	11.2039	
1211.95	39.3328	11.0101	
1231.55	38.9880	10.8195	
1251.47	38.5984	10.6321	
1271.72	38.1570	10.4482	
1292.29	37.6557	10.2678	
1313.19	37.0827	10.0902	
1334.43	36.4228	9.91559	
1356.01	35.6549	9.74396	
1377.94	34.7492	9.57481	
1400.23	33.6611	9.40837	
1422.88	32.3197	9.24456	
1445.89	30.6023	9.08349	
1469.28	28.2649	8.92356	
1493.04	24.6755	8.76393	
1517.19	16.8146	8.60715	
1527.70	-12.2656	8.54057	
1527.90	-12.2632	27.9673	
1541.73	17.6863	27.5146	
1566.67	20.7066	26.7267	
1592.01	21.1665	32.7737	
1617.76	28.0058	38.1199	
1643.92	33.0863	37.2924	
1670.51	36.2941	36.4825	
1697.53	38.7124	35.6898	
1724.99	40.6462	34.9138	
1752.89	42.2350	34.1552	
1781.24	43.5534	33.4131	
1810.05	44.6397	32.6868	
1839.32	45.5061	31.9766	
1869.07	46.1309	31.2819	
1899.30	46.4147	30.6022	
1930.02	45.8822	29.9371	
1949.70	37.9874	29.5242	
1949.90	37.9959	34.5861	
1961.24	45.9966	34.2777	
1992.96	48.9427	33.4388	
2025.20	50.5083	32.6289	
2057.95	51.6357	31.8316	
2091.24	52.4820	31.0545	
2125.06	53.0551	30.2966	
2159.43	53.0529	29.5580	
2172.90	50.2206	29.2767	
2173.10	50.2250	31.2685	
2194.36	54.0527	30.8226	
2229.85	55.2904	30.1017	
2265.92	56.1324	29.3987	
2302.57	56.7874	28.7127	
2339.81	57.2337	28.0441	
2377.66	57.2892	27.7995	
2398.	56.5232	27.6706	
2398.20	56.5371	28.2347	
2416.11	58.0660	27.9491	
2455.19	58.9589	27.3430	
2494.90	59.6138	26.7486	
2535.26	60.1734	26.1654	
2576.26	60.6707	25.5926	
2617.93	61.1210	25.0311	
2660.27	61.5322	24.4800	
2703.30	61.9113	23.9401	
2747.03	62.2605	23.4098	
2791.46	62.5836	22.8906	
2836.61	62.8830	22.3812	
2882.49	63.1611	21.8823	
2929.11	63.4188	21.3930	
2976.48	63.6585	20.9139	
3024.63	63.8806	20.4440	
3073.55	64.0870	19.9843	
3123.26	64.2782	19.5336	
3173.78	64.4557	19.0928	
3225.11	64.6209	18.6608	
3277.27	64.7730	18.2366	
3330.28	64.9135	17.8221	
3384.15	65.0427	17.4160	
3438.88	65.1617	17.0190	
3494.50	65.2714	16.6303	
3551.02	65.3719	16.2490	
3608.46	65.4628	15.8758	
3666.82	65.5461	15.5113	
3726.13	65.6212	15.1532	
3786.40	65.6881	14.8035	
3847.64	65.7483	14.4618	
3909.87	65.8018	14.1268	
3973.11	65.8487	13.7990	
4037.38	65.8892	13.4781	
4102.68	65.9237	13.1644	
4169.03	65.9525	12.8573	
4236.46	65.9757	12.5568	
4304.98	65.9937	12.2629	
4374.62	66.0065	11.9754	
4445.37	66.0144	11.6942	
4517.27	66.0176	11.4193	
4590.33	66.0162	11.1501	
4664.58	66.0103	10.8872	
4740.03	66.0002	10.6299	
4816.69	65.9858	10.3783	
4894.60	65.9674	10.1322	
4973.77	65.9449	9.89160	
5054.21	65.9185	9.65646	
5135.96	65.8882	9.42647	
5219.03	65.8540	9.20169	
5303.44	65.8161	8.98187	
5389.22	65.7743	8.76690	
5476.39	65.7287	8.55681	
5564.97	65.6792	8.35148	
5654.98	65.6259	8.15069	
5746.44	65.5685	7.95443	
5839.39	65.5070	7.76255	
5933.83	65.4413	7.57506	
6029.81	65.3713	7.39164	
6127.33	65.2965	7.21242	
6226.44	65.2169	7.03740	
6327.15	65.1324	6.86626	
6429.48	65.0423	6.69891	
6533.48	64.9464	6.53528	
6639.15	64.8440	6.37539	
6746.54	64.7347	6.21916	
6855.65	64.6178	6.06658	
6966.54	64.4925	5.91726	
7079.22	64.3576	5.77125	
7193.72	64.2120	5.62873	
7310.07	64.0540	5.48919	
7428.31	63.8817	5.35295	
7548.45	63.6927	5.21985	
7670.54	63.4836	5.08953	
7794.61	63.2501	4.96237	
7920.68	62.9867	4.83811	
8048.79	62.6846	4.71641	
8178.98	62.3311	4.59745	
8311.26	61.9065	4.48134	
8445.69	61.3757	4.36767	
8582.29	60.6689	4.25673	
8721.11	59.6096	4.14817	
8862.16	57.4628	4.04219	
8943.50	42.7846	3.98306	
8943.70	42.7860	10.9084	
9005.50	56.9482	10.7698	
9151.16	59.5880	10.4537	
9299.17	60.6463	10.1470	
9449.58	61.1980	9.84905	
9602.42	61.4217	9.55964	
9757.73	61.2884	9.27924	
9915.55	60.2409	9.00674	
9978.10	53.0959	8.90217	
9978.30	53.0966	12.4525	
10075.9	61.0503	12.2317	
10238.9	62.2606	11.8764	
10404.5	62.5320	11.5313	
10486.3	59.2909	11.3666	
10486.5	59.2916	13.0348	
10572.8	63.1842	12.8757	
10743.8	64.2747	12.5699	
10917.6	64.9814	12.2696	
11094.2	65.5375	11.9750	
11273.6	66.0022	11.6859	
11455.9	66.4025	11.4025	
11641.2	66.7533	11.1246	
11829.5	67.0645	10.8522	
12020.8	67.3428	10.5854	
12215.3	67.5933	10.3240	
12412.8	67.8195	10.0680	
12613.6	68.0247	9.81737	
12817.6	68.2113	9.57207	
13025.0	68.3811	9.33202	
13235.6	68.5360	9.09717	
13449.7	68.6774	8.86745	
13667.2	68.8065	8.64279	
13888.3	68.9244	8.42314	
14112.9	69.0321	8.20841	
14341.2	69.1303	7.99854	
14573.1	69.2198	7.79345	
14808.9	69.3013	7.59308	
15048.4	69.3754	7.39733	
15291.8	69.4427	7.20615	
15539.1	69.5036	7.01945	
15790.4	69.5585	6.83714	
16045.8	69.6080	6.65917	
16305.4	69.6523	6.48544	
16569.1	69.6919	6.31587	
16837.1	69.7270	6.15040	
17109.4	69.7579	5.98894	
17386.1	69.7850	5.83141	
17667.4	69.8084	5.67773	
17953.1	69.8285	5.52783	
18243.5	69.8454	5.38163	
18538.6	69.8593	5.23906	
18838.4	69.8705	5.10004	
19143.1	69.8791	4.96449	
19452.7	69.8852	4.83234	
19767.4	69.8891	4.70351	
20087.1	69.8909	4.57794	
20412.0	69.8907	4.45555	
20742.1	69.8887	4.33627	
21077.6	69.8849	4.22003	
21418.5	69.8795	4.10677	
21765.0	69.8726	3.99640	
22117.0	69.8643	3.88888	
22474.7	69.8547	3.78413	
22838.2	69.8438	3.68208	
23207.6	69.8318	3.58268	
23583.0	69.8188	3.48586	
23964.4	69.8047	3.39156	
24352.0	69.7897	3.29971	
24745.9	69.7738	3.21027	
25146.2	69.7571	3.12317	
25552.9	69.7397	3.03835	
25966.2	69.7215	2.95576	
26386.1	69.7027	2.87534	
26812.9	69.6833	2.79705	
27246.6	69.6632	2.72082	
27687.3	69.6427	2.64661	
28135.1	69.6216	2.57436	
28590.2	69.6000	2.50403	
29052.6	69.5780	2.43557	
29522.5	69.5555	2.36892	
30000.0	69.5327	2.30405