kr.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.	0.199153E-14
10.1617	-9999.	0.202374E-14
10.3261	-9999.	0.205647E-14
10.4931	-9999.	0.208974E-14
10.6628	-9999.	0.212354E-14
10.8353	-9999.	0.215788E-14
11.0106	-9999.	0.219278E-14
11.1886	-9999.	0.222825E-14
11.3696	-9999.	0.226429E-14
11.5535	-9999.	0.230091E-14
11.7404	-9999.	0.233813E-14
11.9303	-9999.	0.237595E-14
12.1232	-9999.	0.241438E-14
12.3193	-9999.	0.245343E-14
12.5186	-9999.	0.249311E-14
12.7210	-9999.	0.253343E-14
12.9268	-9999.	0.257441E-14
13.1359	-9999.	0.261605E-14
13.3483	-9999.	0.265836E-14
13.5642	-9999.	0.270136E-14
13.7836	-9999.	0.274505E-14
14.0000	-9999.	0.278814E-14
14.2000	-9999.	6.40385	
14.2331	-9999.	6.46967	
14.4633	-9999.	6.94182	
14.6973	-9999.	7.44844	
14.9350	-9999.	7.89396	
15.1765	-9999.	8.34952	
15.4220	-9999.	8.79845	
15.6714	-9999.	9.10398	
15.9249	-9999.	9.42012	
16.1825	-9999.	9.74725	
16.4442	-9999.	10.0254	
16.7102	-9999.	10.2012	
16.9805	-9999.	10.3801	
17.2551	-9999.	10.5621	
17.5342	-9999.	10.6206	
17.8178	-9999.	10.6327	
18.1060	-9999.	10.6448	
18.3989	-9999.	10.6624	
18.6964	-9999.	10.7073	
18.9988	-9999.	10.7525	
19.3061	-9999.	10.7979	
19.6184	-9999.	10.8398	
19.9357	-9999.	10.8691	
20.2582	-9999.	10.8984	
20.5858	-9999.	10.9277	
20.9188	-9999.	10.9496	
21.2571	-9999.	10.9467	
21.6009	-9999.	10.9439	
21.9503	-9999.	10.9410	
22.3053	-9999.	10.9382	
22.6661	-9999.	10.9049	
23.0327	-9999.	10.8149	
23.4053	-9999.	10.7257	
23.7838	-9999.	10.6372	
24.1685	-9999.	10.5420	
24.5594	-9999.	10.3024	
24.9566	-9999.	10.0683	
25.3603	-9999.	9.83943	
25.7705	-9999.	9.61581	
26.1873	-9999.	9.39726	
26.6109	-9999.	9.18368	
27.0413	-9999.	8.97496	
27.4786	-9999.	8.76542	
27.9231	-9999.	8.53924	
28.3747	-9999.	8.31891	
28.8337	-9999.	8.10425	
29.3000	10.8394	7.78196	
29.7739	11.0262	7.41784	
30.2555	11.1588	7.07074	
30.7449	11.2578	6.73990	
31.2421	11.3317	6.42453	
31.7475	11.3863	6.12392	
32.2609	11.4255	5.83737	
32.7827	11.4529	5.56424	
33.3130	11.4714	5.30389	
33.8518	11.4885	5.05571	
34.3993	11.5152	4.81209	
34.9557	11.5210	4.53378	
35.5211	11.4951	4.27156	
36.0956	11.4528	4.02451	
36.6794	11.3986	3.79174	
37.2727	11.3354	3.57244	
37.8755	11.2649	3.36583	
38.4882	11.1887	3.17116	
39.1107	11.1078	2.98775	
39.7432	11.0234	2.81495	
40.3861	10.9362	2.65214	
41.0393	10.8474	2.49875	
41.7031	10.7597	2.35423	
42.3776	10.6689	2.20946	
43.0630	10.5721	2.07338	
43.7595	10.4721	1.94569	
44.4673	10.3700	1.82585	
45.1865	10.2662	1.71340	
45.9174	10.1611	1.60787	
46.6600	10.0550	1.50884	
47.4147	9.94785	1.41592	
48.1816	9.83975	1.32871	
48.9609	9.73071	1.24688	
49.7528	9.61786	1.17008	
50.5576	9.50454	1.10368	
51.3753	9.39488	1.04268	
52.2062	9.28617	0.985056	
53.0506	9.17754	0.930615	
53.9087	9.06830	0.879182	
54.7806	8.95776	0.830593	
55.6667	8.84475	0.784687	
56.5670	8.72502	0.744512	
57.4820	8.60680	0.717395	
58.4117	8.49511	0.691267	
59.3564	8.38327	0.666091	
60.3165	8.26621	0.641831	
61.2921	8.14684	0.626536	
62.2834	8.03206	0.617524	
63.2908	7.91946	0.608641	
64.3145	7.80632	0.599885	
65.3547	7.69072	0.591540	
66.4118	7.57325	0.586506	
67.4859	7.45430	0.581515	
68.5775	7.32952	0.576566	
69.6867	7.20083	0.576809	
70.8138	7.07047	0.577702	
71.9591	6.93454	0.578596	
73.1230	6.79191	0.581373	
74.3057	6.64226	0.585022	
75.5076	6.48352	0.588694	
76.7289	6.31207	0.592390	
77.9699	6.12486	0.599113	
79.2310	5.92098	0.608538	
80.5125	5.69417	0.618111	
81.8147	5.43659	0.631125	
83.1380	5.13991	0.647678	
84.4827	4.78512	0.664665	
85.8491	4.33656	0.682097	
87.2377	3.72833	0.700901	
88.6487	2.70469	0.726307	
90.0825	0.289705	0.921521	
91.5395	-0.957579	5.96658	
93.0201	1.05818	10.5187	
93.7000	8.54865	13.6057	
93.9000	9.28653	7.23264	
94.5246	7.55698	6.71549	
96.0535	7.64770	5.61185	
97.6071	7.79766	4.68955	
99.1858	7.86211	3.91886	
100.790	7.45947	2.90898	
102.420	6.79340	2.62988	
104.077	6.39007	2.37755	
105.760	5.82447	2.14943	
107.471	5.21766	2.29029	
109.209	4.77435	2.50720	
110.975	4.41724	2.74464	
112.770	4.10060	3.00458	
114.594	3.81458	3.28914	
116.448	3.55724	3.60064	
118.331	3.33856	3.94164	
120.245	3.15294	4.28982	
122.190	2.98237	4.65401	
124.166	2.83666	5.04912	
126.175	2.76626	5.47778	
128.215	2.73919	5.85185	
130.289	2.69105	6.21786	
132.397	2.65291	6.60676	
134.538	2.63849	7.01999	
136.714	2.67067	7.45906	
138.925	2.78840	7.87309	
141.172	2.90982	8.19678	
143.456	2.98108	8.53379	
145.776	3.06023	8.88464	
148.134	3.15101	9.24992	
150.530	3.26068	9.63023	
152.964	3.43776	10.0262	
155.439	3.64212	10.3457	
157.953	3.80711	10.6549	
160.507	3.97342	10.9734	
163.103	4.14864	11.3014	
165.742	4.33952	11.6392	
168.422	4.59171	11.9871	
171.146	4.86869	12.2584	
173.915	5.10268	12.5063	
176.727	5.32626	12.7593	
179.586	5.54767	13.0173	
182.491	5.77214	13.2806	
185.442	6.00366	13.5491	
188.442	6.24921	13.8231	
191.489	6.51217	14.0862	
194.587	6.77744	14.3388	
197.734	7.04232	14.5959	
200.932	7.31834	14.8577	
204.182	7.61031	15.1241	
207.485	7.93279	15.3953	
210.840	8.28447	15.6229	
214.251	8.62423	15.8259	
217.716	8.95157	16.0315	
221.237	9.28463	16.2397	
224.816	9.62716	16.4507	
228.452	9.98370	16.6644	
232.147	10.3767	16.8809	
235.902	10.7988	17.0634	
239.717	11.2124	17.2027	
243.595	11.6170	17.3431	
247.535	12.0297	17.4848	
251.538	12.4590	17.6275	
255.607	12.9563	17.7714	
259.741	13.5018	17.8289	
263.942	13.9959	17.7655	
268.211	14.4236	17.7023	
272.549	14.8207	17.6394	
276.957	15.1968	17.5766	
281.437	15.5569	17.5141	
285.989	15.9042	17.4518	
290.615	16.2410	17.3898	
295.315	16.5689	17.3279	
300.092	16.8893	17.2663	
304.945	17.2032	17.2049	
309.878	17.5117	17.1437	
314.890	17.8155	17.0827	
319.983	18.1153	17.0220	
325.158	18.4120	16.9614	
330.418	18.7061	16.9011	
335.762	18.9984	16.8410	
341.192	19.2895	16.7811	
346.711	19.5802	16.7214	
352.319	19.8713	16.6619	
358.017	20.1638	16.6027	
363.808	20.4589	16.5436	
369.692	20.7582	16.4848	
375.672	21.0638	16.4261	
381.748	21.3793	16.3677	
387.922	21.7112	16.3095	
394.197	22.0815	16.2515	
400.573	22.4950	16.1096	
407.052	22.8621	15.8945	
413.635	23.1645	15.6822	
420.326	23.4456	15.4728	
427.124	23.7081	15.2661	
434.032	23.9559	15.0623	
441.052	24.1912	14.8611	
448.186	24.4158	14.6626	
455.435	24.6312	14.4668	
462.802	24.8384	14.2736	
470.287	25.0385	14.0830	
477.894	25.2324	13.8949	
485.623	25.4208	13.7093	
493.478	25.6048	13.5263	
501.459	25.7853	13.3456	
509.570	25.9639	13.1674	
517.812	26.1428	12.9916	
526.187	26.3280	12.8180	
534.698	26.5275	12.6261	
543.346	26.7112	12.4012	
552.134	26.8628	12.1802	
561.065	27.0027	11.9632	
570.139	27.1319	11.7500	
579.361	27.2521	11.5407	
588.732	27.3644	11.3351	
598.254	27.4695	11.1331	
607.930	27.5681	10.9348	
617.763	27.6606	10.7399	
627.755	27.7476	10.5486	
637.908	27.8292	10.3606	
648.226	27.9059	10.1760	
658.711	27.9778	9.99473	
669.365	28.0448	9.81665	
680.191	28.1059	9.64174	
691.193	28.1626	9.47575	
702.372	28.2198	9.31367	
713.733	28.2760	9.15437	
725.277	28.3308	8.99778	
737.008	28.3845	8.84388	
748.928	28.4379	8.69260	
761.042	28.4920	8.54392	
773.351	28.5508	8.39778	
785.859	28.6142	8.23913	
798.570	28.6680	8.07410	
811.486	28.7136	7.91237	
824.611	28.7575	7.75389	
837.949	28.8231	7.59857	
851.502	28.8857	7.38934	
865.274	28.8974	7.18259	
879.269	28.8929	6.98164	
893.491	28.8580	6.78630	
907.943	28.8088	6.62975	
922.628	28.7774	6.48274	
937.551	28.7441	6.33898	
952.715	28.7084	6.19842	
968.124	28.6686	6.06097	
983.783	28.6237	5.92976	
999.695	28.5774	5.80528	
1015.86	28.5313	5.68331	
1032.29	28.4827	5.56282	
1048.99	28.4308	5.44350	
1065.96	28.3741	5.32525	
1083.20	28.3117	5.20963	
1100.72	28.2444	5.09652	
1118.52	28.1719	4.98588	
1136.61	28.0937	4.87750	
1155.	28.0094	4.77150	
1173.68	27.9187	4.66785	
1192.66	27.8211	4.56656	
1211.95	27.7161	4.46740	
1231.55	27.6032	4.37029	
1251.47	27.4815	4.27450	
1271.72	27.3493	4.17976	
1292.29	27.2048	4.08583	
1313.19	27.0460	3.99420	
1334.43	26.8719	3.90460	
1356.01	26.6802	3.81693	
1377.94	26.4683	3.73116	
1400.23	26.2325	3.64734	
1422.88	25.9685	3.56549	
1445.89	25.6705	3.48534	
1469.28	25.3302	3.40650	
1493.04	24.9372	3.32874	
1517.19	24.4731	3.24928	
1541.73	23.9095	3.17129	
1566.67	23.2068	3.09524	
1592.01	22.2886	3.02097	
1617.76	20.9931	2.94847	
1643.92	18.8648	2.87773	
1670.51	13.0823	2.80869	
1678.30	-4.63584	2.78898	
1678.50	-4.62919	15.6136	
1697.53	17.0270	15.3883	
1724.99	20.8321	15.0732	
1752.89	22.8532	14.7646	
1781.24	24.2250	14.4623	
1810.05	25.2396	14.1664	
1839.32	26.0064	13.8762	
1869.07	26.5511	13.5920	
1899.30	26.7802	13.3139	
1920.90	24.2882	13.1213	
1921.10	24.2985	14.9155	
1930.02	26.9138	14.8244	
1961.24	28.3254	14.5131	
1992.96	29.1554	14.2083	
2025.20	29.8180	13.9160	
2057.95	30.3918	13.6174	
2091.24	30.8934	13.3218	
2125.06	31.3415	13.0295	
2159.43	31.7464	12.7411	
2194.36	32.1150	12.4559	
2229.85	32.4520	12.1748	
2265.92	32.7615	11.8976	
2302.57	33.0465	11.6247	
2339.81	33.3097	11.3558	
2377.66	33.5529	11.0912	
2416.11	33.7781	10.8307	
2455.19	33.9866	10.5747	
2494.90	34.1801	10.3230	
2535.26	34.3593	10.0756	
2576.26	34.5255	9.83282	
2617.93	34.6797	9.59460	
2660.27	34.8230	9.36072	
2703.30	34.9555	9.13092	
2747.03	35.0780	8.90593	
2791.46	35.1916	8.68546	
2836.61	35.2968	8.46952	
2882.49	35.3941	8.25728	
2929.11	35.4833	8.04995	
2976.48	35.5657	7.84690	
3024.63	35.6416	7.64801	
3073.55	35.7112	7.45348	
3123.26	35.7749	7.26281	
3173.78	35.8329	7.07654	
3225.11	35.8856	6.89435	
3277.27	35.9335	6.71681	
3330.28	35.9771	6.54248	
3384.15	36.0161	6.37239	
3438.88	36.0511	6.20619	
3494.50	36.0822	6.04386	
3551.02	36.1096	5.88526	
3608.46	36.1336	5.73038	
3666.82	36.1544	5.57916	
3726.13	36.1722	5.43160	
3786.40	36.1871	5.28752	
3847.64	36.1993	5.14690	
3909.87	36.2090	5.00974	
3973.11	36.2163	4.87588	
4037.38	36.2214	4.74538	
4102.68	36.2243	4.61805	
4169.03	36.2253	4.49384	
4236.46	36.2244	4.37277	
4304.98	36.2218	4.25480	
4374.62	36.2175	4.13972	
4445.37	36.2117	4.02756	
4517.27	36.2045	3.91828	
4590.33	36.1959	3.81176	
4664.58	36.1860	3.70796	
4740.03	36.1750	3.60688	
4816.69	36.1628	3.50840	
4894.60	36.1496	3.41247	
4973.77	36.1355	3.31899	
5054.21	36.1204	3.22800	
5135.96	36.1046	3.13937	
5219.03	36.0878	3.05306	
5303.44	36.0704	2.96911	
5389.22	36.0523	2.88729	
5476.39	36.0335	2.80768	
5564.97	36.0142	2.73020	
5654.98	35.9943	2.65474	
5746.44	35.9739	2.58136	
5839.39	35.9530	2.50992	
5933.83	35.9317	2.44042	
6029.81	35.9099	2.37272	
6127.33	35.8877	2.30688	
6226.44	35.8652	2.24288	
6327.15	35.8423	2.18063	
6429.48	35.8191	2.12003	
6533.48	35.7956	2.06099	
6639.15	35.7717	2.00370	
6746.54	35.7476	1.94791	
6855.65	35.7232	1.89369	
6966.54	35.6986	1.84086	
7079.22	35.6737	1.78961	
7193.72	35.6485	1.73966	
7310.07	35.6230	1.69116	
7428.31	35.5973	1.64394	
7548.45	35.5713	1.59812	
7670.54	35.5451	1.55357	
7794.61	35.5186	1.51016	
7920.68	35.4917	1.46798	
8048.79	35.4646	1.42699	
8178.98	35.4371	1.38714	
8311.26	35.4093	1.34841	
8445.69	35.3810	1.31076	
8582.29	35.3524	1.27415	
8721.11	35.3233	1.23858	
8862.16	35.2938	1.20400	
9005.50	35.2636	1.17038	
9151.16	35.2329	1.13772	
9299.17	35.2015	1.10596	
9449.58	35.1694	1.07511	
9602.42	35.1365	1.04512	
9757.73	35.1027	1.01597	
9915.55	35.0679	0.987623	
10075.9	35.0319	0.960095	
10238.9	34.9947	0.933343	
10404.5	34.9560	0.907347	
10572.8	34.9157	0.882083	
10743.8	34.8735	0.857534	
10917.6	34.8292	0.833678	
11094.2	34.7824	0.810496	
11273.6	34.7329	0.787970	
11455.9	34.6800	0.766083	
11641.2	34.6231	0.744814	
11829.5	34.5617	0.724147	
12020.8	34.4947	0.704066	
12215.3	34.4209	0.684553	
12412.8	34.3387	0.665594	
12613.6	34.2459	0.647172	
12817.6	34.1393	0.629272	
13025.0	34.0141	0.611880	
13235.6	33.8631	0.594980	
13449.7	33.6737	0.578561	
13667.2	33.4217	0.562606	
13888.3	33.0515	0.547104	
14112.9	32.3765	0.532041	
14325.5	24.6680	0.518379	
14325.7	24.6682	3.71186	
14341.2	29.8148	3.70575	
14573.1	32.7062	3.61611	
14808.9	33.4370	3.52804	
15048.4	33.8836	3.44154	
15291.8	34.2071	3.35662	
15539.1	34.4605	3.27328	
15790.4	34.6679	3.19153	
16045.8	34.8428	3.11136	
16305.4	34.9931	3.03277	
16569.1	35.1241	2.95576	
16837.1	35.2397	2.88030	
17109.4	35.3423	2.80641	
17386.1	35.4342	2.73407	
17667.4	35.5168	2.66326	
17953.1	35.5913	2.59397	
18243.5	35.6589	2.52618	
18538.6	35.7202	2.45989	
18838.4	35.7759	2.39507	
19143.1	35.8268	2.33171	
19452.7	35.8731	2.26978	
19767.4	35.9154	2.20927	
20087.1	35.9541	2.15016	
20412.0	35.9894	2.09242	
20742.1	36.0216	2.03604	
21077.6	36.0510	1.98100	
21418.5	36.0779	1.92727	
21765.0	36.1023	1.87484	
22117.0	36.1246	1.82367	
22474.7	36.1448	1.77375	
22838.2	36.1632	1.72506	
23207.6	36.1798	1.67757	
23583.0	36.1947	1.63126	
23964.4	36.2082	1.58611	
24352.0	36.2203	1.54209	
24745.9	36.2311	1.49919	
25146.2	36.2406	1.45737	
25552.9	36.2491	1.41663	
25966.2	36.2565	1.37693	
26386.1	36.2629	1.33825	
26812.9	36.2684	1.30058	
27246.6	36.2730	1.26388	
27687.3	36.2769	1.22815	
28135.1	36.2801	1.19335	
28590.2	36.2826	1.15948	
29052.6	36.2846	1.12649	
29522.5	36.2891	1.09439	
30000.0	36.2768	1.06314