k.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.	0.342643E-01
10.1617	-9999.	0.352921E-01
10.3261	-9999.	0.363507E-01
10.4931	-9999.	0.374410E-01
10.6628	-9999.	0.385641E-01
10.8353	-9999.	0.397209E-01
11.0106	-9999.	0.409123E-01
11.1886	-9999.	0.421395E-01
11.3696	-9999.	0.434035E-01
11.5535	-9999.	0.447054E-01
11.7404	-9999.	0.458918E-01
11.9303	-9999.	0.467761E-01
12.1232	-9999.	0.476775E-01
12.3193	-9999.	0.485962E-01
12.5186	-9999.	0.495326E-01
12.7210	-9999.	0.505034E-01
12.9268	-9999.	0.515183E-01
13.1359	-9999.	0.525536E-01
13.3483	-9999.	0.536097E-01
13.5642	-9999.	0.547076E-01
13.7836	-9999.	0.558610E-01
14.0066	-9999.	0.570387E-01
14.2331	-9999.	0.582413E-01
14.4633	-9999.	0.594692E-01
14.6973	-9999.	0.608386E-01
14.9350	-9999.	0.623585E-01
15.1765	-9999.	0.639162E-01
15.4220	-9999.	0.655129E-01
15.6714	-9999.	0.667297E-01
15.9249	-9999.	0.698655E-01
16.1825	-9999.	0.778034E-01
16.4442	-9999.	0.927407E-01
16.7102	-9999.	0.101038	
16.9805	-9999.	0.100077	
17.2551	-9999.	0.991247E-01
17.5342	-9999.	0.972030E-01
17.8178	-9999.	0.101597	
18.1060	-9999.	0.125934	
18.3989	-9999.	0.169815	
18.6964	-9999.	0.232685	
18.9988	-9999.	0.316999	
19.3061	-9999.	0.445772	
19.6184	-9999.	0.695715	
19.9357	-9999.	1.36743	
20.2582	-9999.	4.67523	
20.5858	-9999.	5.53876	
20.9188	-9999.	6.01936	
21.2571	-9999.	6.54165	
21.6009	-9999.	7.10926	
21.9503	-9999.	7.72612	
22.3053	-9999.	8.21083	
22.6661	-9999.	8.65970	
23.0327	-9999.	9.13312	
23.4053	-9999.	9.63242	
23.7838	-9999.	10.1590	
24.1685	-9999.	10.7136	
24.5594	-9999.	11.2607	
24.9566	-9999.	11.8358	
25.3603	-9999.	12.4402	
25.7705	-9999.	13.0756	
26.1873	-9999.	13.6526	
26.6109	-9999.	13.9461	
27.0413	-9999.	14.2459	
27.4786	-9999.	14.5521	
27.9231	-9999.	14.8649	
28.3747	-9999.	15.1844	
28.8337	-9999.	15.4706	
29.3000	2.17828	15.5477	
29.7739	2.89939	15.6251	
30.2555	3.60817	15.7029	
30.7449	4.33571	15.7812	
31.2421	5.11707	15.8598	
31.7475	6.03373	15.8136	
32.2609	6.83119	15.6376	
32.7827	7.59044	15.4635	
33.3130	8.35387	15.2914	
33.8518	9.18461	15.1212	
34.3993	10.1988	14.9437	
34.9557	11.1641	14.2499	
35.5211	11.9451	13.5883	
36.0956	12.6035	12.7896	
36.6794	13.1354	12.0324	
37.2727	13.6803	11.2669	
37.8755	14.0504	10.2831	
38.4882	14.2223	9.38513	
39.1107	14.2816	8.58297	
39.7432	14.2982	7.85498	
40.3861	14.3079	7.15591	
41.0393	14.2245	6.45992	
41.7031	14.0687	5.83162	
42.3776	13.8619	5.30530	
43.0630	13.6892	4.85617	
43.7595	13.5444	4.44507	
44.4673	13.4567	4.02366	
45.1865	13.3321	3.58281	
45.9174	13.2702	3.08053	
46.6600	12.9741	2.51309	
47.4147	12.6173	2.14018	
48.1816	12.2824	1.81928	
48.9609	11.9613	1.54490	
49.7528	11.6417	1.28830	
50.5576	11.3082	1.07234	
51.3753	10.9768	0.896454	
52.2062	10.6439	0.757394	
53.0506	10.3154	0.680178	
53.9087	10.0364	0.632986	
54.7806	9.78031	0.595014	
55.6667	9.52988	0.567394	
56.5670	9.30251	0.563239	
57.4820	9.08725	0.559115	
58.4117	8.88646	0.580718	
59.3564	8.70392	0.603395	
60.3165	8.53101	0.632560	
61.2921	8.36576	0.665632	
62.2834	8.21156	0.717531	
63.2908	8.07110	0.775782	
64.3145	7.95287	0.845525	
65.3547	7.85046	0.900273	
66.4118	7.75086	0.956547	
67.4859	7.65588	1.01634	
68.5775	7.56768	1.08251	
69.6867	7.49048	1.15442	
70.8138	7.42753	1.22789	
71.9591	7.37201	1.30013	
73.1230	7.32952	1.37551	
74.3057	7.29481	1.44167	
75.5076	7.26818	1.51100	
76.7289	7.25548	1.57080	
77.9699	7.23965	1.62391	
79.2310	7.22539	1.67882	
80.5125	7.21927	1.73393	
81.8147	7.21605	1.78266	
83.1380	7.21683	1.83276	
84.4827	7.22962	1.87923	
85.8491	7.23996	1.91557	
87.2377	7.24975	1.95261	
88.6487	7.26385	1.99038	
90.0825	7.28835	2.02887	
91.5395	7.32647	2.04612	
93.0201	7.34617	2.04724	
94.5246	7.35113	2.05287	
96.0535	7.35863	2.06874	
97.6071	7.36896	2.08473	
99.1858	7.38203	2.10085	
100.790	7.40104	2.11708	
102.420	7.42005	2.11875	
104.077	7.43219	2.11934	
105.760	7.44000	2.12303	
107.471	7.44795	2.12778	
109.209	7.45588	2.13254	
110.975	7.46350	2.13731	
112.770	7.47092	2.14210	
114.594	7.47826	2.14689	
116.448	7.48564	2.15169	
118.331	7.49328	2.15651	
120.245	7.50143	2.16134	
122.190	7.51077	2.16617	
124.166	7.52417	2.17102	
126.175	7.53841	2.16638	
128.215	7.54694	2.15912	
130.289	7.55225	2.15189	
132.397	7.55533	2.14468	
134.538	7.55656	2.13750	
136.714	7.55614	2.13034	
138.925	7.55417	2.12321	
141.172	7.55074	2.11610	
143.456	7.54589	2.10901	
145.776	7.53966	2.10195	
148.134	7.53209	2.09491	
150.530	7.52324	2.08789	
152.964	7.51323	2.08090	
155.439	7.50233	2.07393	
157.953	7.49164	2.06698	
160.507	7.48139	2.05512	
163.103	7.46576	2.04042	
165.742	7.44542	2.02582	
168.422	7.42167	2.01133	
171.146	7.39460	1.99694	
173.915	7.36422	1.98265	
176.727	7.33048	1.96847	
179.586	7.29328	1.95439	
182.491	7.25250	1.94040	
185.442	7.20801	1.92652	
188.442	7.15973	1.91274	
191.489	7.10773	1.89906	
194.587	7.05416	1.88350	
197.734	6.99268	1.86442	
200.932	6.92322	1.84554	
204.182	6.84662	1.82685	
207.485	6.76249	1.80835	
210.840	6.67029	1.79004	
214.251	6.56932	1.77191	
217.716	6.45876	1.75396	
221.237	6.33761	1.73620	
224.816	6.20474	1.71862	
228.452	6.05931	1.70121	
232.147	5.89900	1.68210	
235.902	5.71985	1.66224	
239.717	5.51965	1.64263	
243.595	5.29526	1.62324	
247.535	5.04239	1.60408	
251.538	4.75543	1.58514	
255.607	4.42684	1.56643	
259.741	4.04630	1.54794	
263.942	3.59913	1.52967	
268.211	3.06355	1.51162	
272.549	2.40521	1.49378	
276.957	1.56542	1.47615	
281.437	0.431087	1.45872	
285.989	-1.26306	1.44151	
290.615	-4.44727	1.42449	
294.500	-20.3956	1.41056	
294.700	-20.3757	15.1908	
295.315	-11.6988	15.1664	
300.092	-2.52151	14.9798	
304.945	0.431010	14.7956	
309.878	2.28661	14.6136	
314.890	3.65714	14.4338	
319.983	4.77056	14.2533	
325.158	5.67861	14.0256	
330.418	6.38330	13.8016	
335.762	6.97894	13.6815	
341.192	7.55127	13.5912	
346.711	8.09103	13.5014	
352.319	8.59859	13.4122	
358.017	9.07834	13.3237	
363.808	9.53481	13.2357	
369.692	9.97229	13.1483	
375.672	10.3950	13.0614	
381.748	10.8073	12.9752	
387.922	11.2153	12.8895	
394.197	11.6332	12.8044	
400.573	12.0738	12.6680	
407.052	12.4681	12.4871	
413.635	12.8177	12.3088	
420.326	13.1462	12.1331	
427.124	13.4581	11.9598	
434.032	13.7573	11.7891	
441.052	14.0477	11.6208	
448.186	14.3341	11.4549	
455.435	14.6450	11.2717	
462.802	14.9211	11.0479	
470.287	15.1597	10.8286	
477.894	15.3801	10.6137	
485.623	15.5850	10.4030	
493.478	15.7769	10.1965	
501.459	15.9574	9.99408	
509.570	16.1280	9.79571	
517.812	16.2904	9.60126	
526.187	16.4479	9.41067	
534.698	16.5981	9.21457	
543.346	16.7364	9.01953	
552.134	16.8636	8.82863	
561.065	16.9827	8.64175	
570.139	17.0945	8.45884	
579.361	17.1996	8.27979	
588.732	17.2986	8.10455	
598.254	17.3921	7.93301	
607.930	17.4804	7.76509	
617.763	17.5642	7.60074	
627.755	17.6437	7.43986	
637.908	17.7194	7.28238	
648.226	17.7918	7.12825	
658.711	17.8615	6.97737	
669.365	17.9291	6.82968	
680.191	17.9954	6.68513	
691.193	18.0704	6.54362	
702.372	18.1410	6.38391	
713.733	18.1966	6.22354	
725.277	18.2431	6.06719	
737.008	18.2830	5.91477	
748.928	18.3173	5.76619	
761.042	18.3467	5.62133	
773.351	18.3715	5.48011	
785.859	18.3921	5.34244	
798.570	18.4085	5.20823	
811.486	18.4208	5.07739	
824.611	18.4287	4.94984	
837.949	18.4316	4.82549	
851.502	18.4291	4.70427	
865.274	18.4042	4.59328	
879.269	18.3888	4.51185	
893.491	18.3893	4.43187	
907.943	18.3943	4.35330	
922.628	18.4029	4.27613	
937.551	18.4148	4.20032	
952.715	18.4300	4.12586	
968.124	18.4482	4.05272	
983.783	18.4883	3.97264	
999.695	18.5140	3.87209	
1015.86	18.5248	3.77870	
1032.29	18.5338	3.68757	
1048.99	18.5404	3.59863	
1065.96	18.5450	3.51184	
1083.20	18.5478	3.42714	
1100.72	18.5491	3.34449	
1118.52	18.5492	3.26383	
1136.61	18.5481	3.18511	
1155.	18.5462	3.10829	
1173.68	18.5434	3.03333	
1192.66	18.5401	2.96017	
1211.95	18.5365	2.88878	
1231.55	18.5339	2.81779	
1251.47	18.5294	2.74598	
1271.72	18.5225	2.67600	
1292.29	18.5143	2.60781	
1313.19	18.5050	2.54135	
1334.43	18.4949	2.47659	
1356.01	18.4840	2.41347	
1377.94	18.4724	2.35197	
1400.23	18.4602	2.29203	
1422.88	18.4473	2.23362	
1445.89	18.4340	2.17669	
1469.28	18.4201	2.12122	
1493.04	18.4059	2.06717	
1517.19	18.3912	2.01449	
1541.73	18.3761	1.96315	
1566.67	18.3607	1.91312	
1592.01	18.3450	1.86437	
1617.76	18.3291	1.81685	
1643.92	18.3130	1.77055	
1670.51	18.2970	1.72543	
1697.53	18.2816	1.68055	
1724.99	18.2652	1.63522	
1752.89	18.2472	1.59110	
1781.24	18.2285	1.54818	
1810.05	18.2091	1.50641	
1839.32	18.1892	1.46577	
1869.07	18.1687	1.42623	
1899.30	18.1476	1.38775	
1930.02	18.1260	1.35032	
1961.24	18.1039	1.31389	
1992.96	18.0813	1.27844	
2025.20	18.0581	1.24395	
2057.95	18.0344	1.21039	
2091.24	18.0101	1.17774	
2125.06	17.9852	1.14597	
2159.43	17.9596	1.11505	
2194.36	17.9335	1.08497	
2229.85	17.9066	1.05570	
2265.92	17.8791	1.02722	
2302.57	17.8510	0.999227	
2339.81	17.8216	0.971618	
2377.66	17.7910	0.944773	
2416.11	17.7592	0.918669	
2455.19	17.7260	0.893287	
2494.90	17.6915	0.868606	
2535.26	17.6553	0.844607	
2576.26	17.6175	0.821271	
2617.93	17.5778	0.798579	
2660.27	17.5359	0.776515	
2703.30	17.4916	0.755060	
2747.03	17.4445	0.734198	
2791.46	17.3944	0.713912	
2836.61	17.3406	0.694188	
2882.49	17.2827	0.675007	
2929.11	17.2199	0.656357	
2976.48	17.1511	0.638223	
3024.63	17.0755	0.621143	
3073.55	16.9919	0.604654	
3123.26	16.8983	0.588601	
3173.78	16.7918	0.572976	
3225.11	16.6688	0.557765	
3277.27	16.5236	0.542959	
3330.28	16.3475	0.528544	
3384.15	16.1255	0.514513	
3438.88	15.8296	0.500854	
3494.50	15.3954	0.487557	
3551.02	14.6156	0.474616	
3608.30	6.76821	0.462049	
3608.50	6.76945	4.40540	
3666.82	14.8853	4.28666	
3726.13	15.8359	4.17104	
3786.40	16.4059	4.05853	
3847.64	16.8151	3.94907	
3909.87	17.1335	3.84255	
3973.11	17.3929	3.73891	
4037.38	17.6105	3.63805	
4102.68	17.7967	3.53994	
4169.03	17.9585	3.44445	
4236.46	18.1006	3.35155	
4304.98	18.2265	3.26115	
4374.62	18.3388	3.17319	
4445.37	18.4395	3.08760	
4517.27	18.5302	3.00431	
4590.33	18.6121	2.92328	
4664.58	18.6865	2.84443	
4740.03	18.7541	2.76771	
4816.69	18.8156	2.69306	
4894.60	18.8717	2.62042	
4973.77	18.9230	2.54974	
5054.21	18.9699	2.48097	
5135.96	19.0128	2.41405	
5219.03	19.0521	2.34893	
5303.44	19.0881	2.28558	
5389.22	19.1212	2.22393	
5476.39	19.1516	2.16370	
5564.97	19.1793	2.10490	
5654.98	19.2046	2.04770	
5746.44	19.2275	1.99206	
5839.39	19.2485	1.93793	
5933.83	19.2675	1.88526	
6029.81	19.2848	1.83403	
6127.33	19.3006	1.78419	
6226.44	19.3148	1.73571	
6327.15	19.3277	1.68854	
6429.48	19.3393	1.64266	
6533.48	19.3498	1.59802	
6639.15	19.3593	1.55459	
6746.54	19.3677	1.51235	
6855.65	19.3753	1.47125	
6966.54	19.3821	1.43127	
7079.22	19.3881	1.39237	
7193.72	19.3936	1.35453	
7310.07	19.3987	1.31772	
7428.31	19.4041	1.28192	
7548.45	19.4094	1.24556	
7670.54	19.4131	1.20849	
7794.61	19.4150	1.17252	
7920.68	19.4159	1.13763	
8048.79	19.4158	1.10377	
8178.98	19.4151	1.07092	
8311.26	19.4136	1.03905	
8445.69	19.4115	1.00813	
8582.29	19.4087	0.978123	
8721.11	19.4052	0.949014	
8862.16	19.4010	0.921145	
9005.50	19.3966	0.894684	
9151.16	19.3921	0.868973	
9299.17	19.3872	0.843999	
9449.58	19.3818	0.819666	
9602.42	19.3746	0.796023	
9757.73	19.3633	0.773049	
9915.55	19.3598	0.768755	
10075.9	19.3678	0.746466	
10238.9	19.3646	0.724791	
10404.5	19.3619	0.703714	
10572.8	19.3588	0.683220	
10743.8	19.3553	0.663294	
10917.6	19.3515	0.643921	
11094.2	19.3475	0.625088	
11273.6	19.3432	0.606779	
11455.9	19.3389	0.588981	
11641.2	19.3344	0.571681	
11829.5	19.3298	0.554865	
12020.8	19.3251	0.538520	
12215.3	19.3203	0.522634	
12412.8	19.3154	0.507196	
12613.6	19.3106	0.492191	
12817.6	19.3056	0.477610	
13025.0	19.3007	0.463440	
13235.6	19.2957	0.449671	
13449.7	19.2907	0.436292	
13667.2	19.2857	0.423291	
13888.3	19.2807	0.410659	
14112.9	19.2756	0.398386	
14341.2	19.2706	0.386461	
14573.1	19.2657	0.374876	
14808.9	19.2607	0.363621	
15048.4	19.2557	0.352686	
15291.8	19.2508	0.342063	
15539.1	19.2459	0.331743	
15790.4	19.2411	0.321718	
16045.8	19.2362	0.311980	
16305.4	19.2314	0.302520	
16569.1	19.2267	0.293331	
16837.1	19.2220	0.284406	
17109.4	19.2173	0.275736	
17386.1	19.2127	0.267315	
17667.4	19.2081	0.259135	
17953.1	19.2036	0.251191	
18243.5	19.1991	0.243474	
18538.6	19.1947	0.235980	
18838.4	19.1903	0.228701	
19143.1	19.1860	0.221631	
19452.7	19.1817	0.214765	
19767.4	19.1775	0.208096	
20087.1	19.1733	0.201622	
20412.0	19.1692	0.195337	
20742.1	19.1652	0.189239	
21077.6	19.1611	0.183324	
21418.5	19.1572	0.177585	
21765.0	19.1533	0.172019	
22117.0	19.1494	0.166620	
22474.7	19.1457	0.161384	
22838.2	19.1419	0.156305	
23207.6	19.1382	0.151379	
23583.0	19.1346	0.146603	
23964.4	19.1311	0.141971	
24352.0	19.1276	0.137480	
24745.9	19.1241	0.133125	
25146.2	19.1208	0.128903	
25552.9	19.1174	0.124809	
25966.2	19.1142	0.120840	
26386.1	19.1109	0.116993	
26812.9	19.1078	0.113263	
27246.6	19.1047	0.109648	
27687.3	19.1017	0.106144	
28135.1	19.0987	0.102747	
28590.2	19.0957	0.994554E-01
29052.6	19.0929	0.962650E-01
29522.5	19.0900	0.931731E-01
30000.0	19.0873	0.901768E-01