sc.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.	0.718390	
10.1617	-9999.	0.721028	
10.3261	-9999.	0.723674	
10.4931	-9999.	0.726332	
10.6628	-9999.	0.728998	
10.8353	-9999.	0.731674	
11.0106	-9999.	0.734361	
11.1886	-9999.	0.737057	
11.3696	-9999.	0.739762	
11.5535	-9999.	0.742479	
11.7404	-9999.	0.745204	
11.9303	-9999.	0.747941	
12.1232	-9999.	0.750686	
12.3193	-9999.	0.753442	
12.5186	-9999.	0.757071	
12.7210	-9999.	0.764374	
12.9268	-9999.	0.771748	
13.1359	-9999.	0.779191	
13.3483	-9999.	0.786707	
13.5642	-9999.	0.794296	
13.7836	-9999.	0.801957	
14.0066	-9999.	0.808912	
14.2331	-9999.	0.814411	
14.4633	-9999.	0.819947	
14.6973	-9999.	0.825521	
14.9350	-9999.	0.831133	
15.1765	-9999.	0.836783	
15.4220	-9999.	0.838413	
15.6714	-9999.	0.837940	
15.9249	-9999.	0.837469	
16.1825	-9999.	0.836997	
16.4442	-9999.	0.836526	
16.7102	-9999.	0.835620	
16.9805	-9999.	0.834687	
17.2551	-9999.	0.833756	
17.5342	-9999.	0.832825	
17.8178	-9999.	0.832470	
18.1060	-9999.	0.833061	
18.3989	-9999.	0.833651	
18.6964	-9999.	0.834242	
18.9988	-9999.	0.834834	
19.3061	-9999.	0.832440	
19.6184	-9999.	0.829454	
19.9357	-9999.	0.826479	
20.2582	-9999.	0.823514	
20.5858	-9999.	0.819048	
20.9188	-9999.	0.814321	
21.2571	-9999.	0.809622	
21.6009	-9999.	0.803856	
21.9503	-9999.	0.795100	
22.3053	-9999.	0.786439	
22.6661	-9999.	0.777873	
23.0327	-9999.	0.769399	
23.4053	-9999.	0.761018	
23.7838	-9999.	0.757563	
24.1685	-9999.	0.755529	
24.5594	-9999.	0.753501	
24.9566	-9999.	0.751478	
25.3603	-9999.	0.744207	
25.7705	-9999.	0.733462	
26.1873	-9999.	0.722873	
26.6109	-9999.	0.712436	
27.0413	-9999.	0.702150	
27.4786	-9999.	0.692012	
27.9231	-9999.	0.682021	
28.3747	-9999.	0.670874	
28.8337	-9999.	0.659558	
29.3000	-1.03670	0.648433	
29.7739	-1.41804	0.639876	
30.2555	-1.85352	0.635538	
30.7449	-2.36056	0.632347	
31.2421	-2.95389	0.640375	
31.7475	-3.66154	0.648505	
32.2609	-4.53664	0.664896	
32.7827	-5.64255	0.693025	
33.3130	-7.12157	0.753797	
33.8518	-9.33431	0.858911	
34.3993	-13.4259	1.12517	
34.9557	-20.3771	2.27399	
35.5211	-13.1226	16.7055	
36.0956	-9.32270	18.4001	
36.6794	-6.68263	19.2468	
37.2727	-4.56713	19.9561	
37.8755	-2.57290	20.6915	
38.4882	-0.285373	21.1216	
39.1107	1.64931	21.1561	
39.7432	3.53583	21.1907	
40.3861	5.71979	20.8812	
41.0393	7.39816	20.1306	
41.7031	8.79766	19.4069	
42.3776	10.0854	18.6806	
43.0630	11.3680	17.9803	
43.7595	12.9326	17.3063	
44.4673	13.7965	15.1369	
45.1865	14.1346	14.0797	
45.9174	14.4929	13.0963	
46.6600	14.8574	12.1816	
47.4147	15.2691	11.1563	
48.1816	15.4202	10.0938	
48.9609	15.4187	9.13432	
49.7528	15.3468	8.28012	
50.5576	15.2363	7.50582	
51.3753	15.1248	6.74857	
52.2062	14.8805	6.00911	
53.0506	14.5463	5.40855	
53.9087	14.2418	4.91012	
54.7806	13.9331	4.46054	
55.6667	13.6019	4.05496	
56.5670	13.2719	3.77227	
57.4820	13.0195	3.53316	
58.4117	12.8489	3.28322	
59.3564	12.5902	2.87835	
60.3165	12.1522	2.62473	
61.2921	11.8258	2.52642	
62.2834	11.5465	2.43178	
63.2908	11.2619	2.36643	
64.3145	11.0317	2.34323	
65.3547	10.8375	2.32026	
66.4118	10.6605	2.29752	
67.4859	10.4895	2.27568	
68.5775	10.3303	2.27375	
69.6867	10.1783	2.27183	
70.8138	10.0407	2.29948	
71.9591	9.92786	2.32958	
73.1230	9.83303	2.36007	
74.3057	9.75043	2.38398	
75.5076	9.67418	2.40742	
76.7289	9.60232	2.43153	
77.9699	9.53929	2.46221	
79.2310	9.48789	2.49328	
80.5125	9.44594	2.51611	
81.8147	9.39639	2.53431	
83.1380	9.35177	2.56806	
84.4827	9.31713	2.60227	
85.8491	9.28963	2.63692	
87.2377	9.26861	2.67204	
88.6487	9.25394	2.70786	
90.0825	9.24674	2.74449	
91.5395	9.25043	2.78163	
93.0201	9.28333	2.81085	
94.5246	9.27792	2.79769	
96.0535	9.27449	2.81938	
97.6071	9.27931	2.84123	
99.1858	9.29196	2.86323	
100.790	9.31514	2.87591	
102.420	9.33092	2.87894	
104.077	9.34377	2.88242	
105.760	9.35555	2.88592	
107.471	9.36635	2.88981	
109.209	9.37756	2.89472	
110.975	9.38932	2.90052	
112.770	9.40358	2.90639	
114.594	9.41893	2.91140	
116.448	9.43501	2.91420	
118.331	9.45042	2.91638	
120.245	9.46559	2.91857	
122.190	9.48093	2.92071	
124.166	9.49644	2.92283	
126.175	9.51226	2.92503	
128.215	9.52847	2.92720	
130.289	9.54505	2.92936	
132.397	9.56198	2.93153	
134.538	9.57940	2.93396	
136.714	9.59766	2.93645	
138.925	9.61668	2.93887	
141.172	9.63658	2.94132	
143.456	9.65766	2.94379	
145.776	9.68033	2.94628	
148.134	9.70558	2.94875	
150.530	9.73928	2.94823	
152.964	9.76953	2.93711	
155.439	9.79638	2.92307	
157.953	9.81876	2.90696	
160.507	9.83767	2.89085	
163.103	9.85428	2.87487	
165.742	9.86901	2.85904	
168.422	9.88172	2.84313	
171.146	9.89151	2.82840	
173.915	9.90083	2.81529	
176.727	9.91047	2.80386	
179.586	9.92074	2.79252	
182.491	9.93397	2.78024	
185.442	9.94504	2.76315	
188.442	9.95388	2.74521	
191.489	9.96025	2.72621	
194.587	9.96401	2.70671	
197.734	9.96572	2.68715	
200.932	9.96539	2.66756	
204.182	9.96325	2.64804	
207.485	9.95964	2.62871	
210.840	9.95600	2.60957	
214.251	9.95013	2.58571	
217.716	9.94061	2.56104	
221.237	9.92664	2.53584	
224.816	9.90906	2.51095	
228.452	9.88815	2.48623	
232.147	9.86374	2.46166	
235.902	9.83582	2.43740	
239.717	9.80434	2.41339	
243.595	9.76916	2.38961	
247.535	9.73011	2.36608	
251.538	9.68701	2.34277	
255.607	9.63962	2.31969	
259.741	9.58769	2.29684	
263.942	9.53099	2.27422	
268.211	9.46929	2.25181	
272.549	9.40260	2.22963	
276.957	9.33177	2.20565	
281.437	9.25257	2.17938	
285.989	9.16375	2.15185	
290.615	9.06495	2.12446	
295.315	8.95552	2.09741	
300.092	8.83472	2.07071	
304.945	8.70134	2.04435	
309.878	8.55389	2.01831	
314.890	8.39051	1.99261	
319.983	8.20895	1.96724	
325.158	8.00639	1.94219	
330.418	7.77925	1.91748	
335.762	7.52301	1.89306	
341.192	7.23166	1.86895	
346.711	6.89727	1.84516	
352.319	6.50888	1.82167	
358.017	6.05087	1.79849	
363.808	5.49980	1.77560	
369.692	4.81839	1.75298	
375.672	3.94191	1.73064	
381.748	2.74289	1.70860	
387.922	0.910264	1.68648	
394.197	-2.76301	1.66385	
398.600	-19.5732	1.64836	
398.800	-19.5551	15.6990	
400.573	-6.34604	15.6350	
407.052	0.592564	15.4058	
413.635	3.37939	15.1799	
420.326	5.18735	14.9575	
427.124	6.53794	14.7383	
434.032	7.61943	14.5221	
441.052	8.52266	14.3091	
448.186	9.30505	14.0949	
455.435	9.97548	13.8626	
462.802	10.5464	13.6278	
470.287	11.0165	13.3936	
477.894	11.3394	13.1636	
485.623	11.5895	13.1716	
493.478	11.9337	13.2692	
501.459	12.3764	13.3676	
509.570	12.8741	13.4667	
517.812	13.6313	13.4823	
526.187	14.2491	13.2005	
534.698	14.6907	12.9476	
543.346	15.0918	12.7107	
552.134	15.4683	12.4782	
561.065	15.8174	12.2392	
570.139	16.1350	11.9999	
579.361	16.4277	11.7658	
588.732	16.7003	11.5372	
598.254	16.9562	11.3134	
607.930	17.1977	11.0938	
617.763	17.4265	10.8785	
627.755	17.6502	10.6668	
637.908	17.8640	10.4494	
648.226	18.0651	10.2229	
658.711	18.2439	9.99254	
669.365	18.3917	9.76701	
680.191	18.5215	9.56857	
691.193	18.6570	9.39095	
702.372	18.8029	9.22064	
713.733	18.9552	9.03461	
725.277	19.0934	8.83959	
737.008	19.2168	8.64923	
748.928	19.3325	8.46290	
761.042	19.4428	8.28040	
773.351	19.5483	8.10035	
785.859	19.6495	7.91903	
798.570	19.7415	7.73757	
811.486	19.8246	7.56020	
824.611	19.9015	7.38693	
837.949	19.9729	7.21764	
851.502	20.0394	7.05186	
865.274	20.1012	6.88953	
879.269	20.1585	6.73063	
893.491	20.2116	6.57546	
907.943	20.2611	6.42385	
922.628	20.3080	6.27571	
937.551	20.3516	6.12927	
952.715	20.3913	5.98577	
968.124	20.4276	5.84522	
983.783	20.4607	5.70808	
999.695	20.4912	5.57411	
1015.86	20.5194	5.44326	
1032.29	20.5457	5.31516	
1048.99	20.5704	5.18876	
1065.96	20.5920	5.06396	
1083.20	20.6103	4.94211	
1100.72	20.6263	4.82322	
1118.52	20.6403	4.70721	
1136.61	20.6523	4.59395	
1155.	20.6626	4.48343	
1173.68	20.6712	4.37560	
1192.66	20.6785	4.27040	
1211.95	20.6845	4.16768	
1231.55	20.6895	4.06736	
1251.47	20.6934	3.96901	
1271.72	20.6964	3.87241	
1292.29	20.6977	3.77740	
1313.19	20.6973	3.68477	
1334.43	20.6958	3.59443	
1356.01	20.6933	3.50629	
1377.94	20.6897	3.42031	
1400.23	20.6854	3.33644	
1422.88	20.6803	3.25460	
1445.89	20.6746	3.17482	
1469.28	20.6685	3.09675	
1493.04	20.6623	3.02021	
1517.19	20.6552	2.94422	
1541.73	20.6465	2.86997	
1566.67	20.6370	2.79758	
1592.01	20.6266	2.72695	
1617.76	20.6155	2.65811	
1643.92	20.6038	2.59105	
1670.51	20.5916	2.52564	
1697.53	20.5789	2.46190	
1724.99	20.5661	2.39982	
1752.89	20.5529	2.33857	
1781.24	20.5390	2.27868	
1810.05	20.5244	2.22021	
1839.32	20.5092	2.16319	
1869.07	20.4935	2.10764	
1899.30	20.4774	2.05356	
1930.02	20.4609	2.00080	
1961.24	20.4440	1.94938	
1992.96	20.4266	1.89933	
2025.20	20.4093	1.85117	
2057.95	20.3919	1.80329	
2091.24	20.3740	1.75656	
2125.06	20.3556	1.71097	
2159.43	20.3368	1.66650	
2194.36	20.3177	1.62311	
2229.85	20.2982	1.58078	
2265.92	20.2783	1.53949	
2302.57	20.2580	1.49923	
2339.81	20.2373	1.45995	
2377.66	20.2162	1.42162	
2416.11	20.1947	1.38425	
2455.19	20.1728	1.34779	
2494.90	20.1504	1.31223	
2535.26	20.1276	1.27756	
2576.26	20.1042	1.24373	
2617.93	20.0803	1.21073	
2660.27	20.0558	1.17854	
2703.30	20.0306	1.14715	
2747.03	20.0049	1.11654	
2791.46	19.9784	1.08667	
2836.61	19.9511	1.05756	
2882.49	19.9230	1.02915	
2929.11	19.8939	1.00143	
2976.48	19.8639	0.974409	
3024.63	19.8327	0.948070	
3073.55	19.8003	0.922364	
3123.26	19.7666	0.897277	
3173.78	19.7314	0.872817	
3225.11	19.6945	0.848979	
3277.27	19.6557	0.825708	
3330.28	19.6149	0.802998	
3384.15	19.5716	0.780866	
3438.88	19.5257	0.759259	
3494.50	19.4767	0.738188	
3551.02	19.4241	0.717638	
3608.46	19.3674	0.697584	
3666.82	19.3058	0.678031	
3726.13	19.2385	0.658943	
3786.40	19.1642	0.640333	
3847.64	19.0816	0.622187	
3909.87	18.9885	0.604462	
3973.11	18.8822	0.587165	
4037.38	18.7586	0.570323	
4102.68	18.6117	0.553858	
4169.03	18.4319	0.537783	
4236.46	18.2021	0.522133	
4304.98	17.8887	0.506841	
4374.62	17.4077	0.491903	
4445.37	16.4209	0.477359	
4492.70	9.35814	0.467995	
4492.90	9.35887	4.10565	
4517.27	15.7678	4.07429	
4590.33	17.4448	3.98268	
4664.58	18.1544	3.89221	
4740.03	18.6180	3.80297	
4816.69	18.9642	3.71494	
4894.60	19.2405	3.62822	
4973.77	19.4699	3.54268	
5054.21	19.6654	3.45845	
5135.96	19.8349	3.37558	
5219.03	19.9840	3.29407	
5303.44	20.1164	3.21390	
5389.22	20.2349	3.13511	
5476.39	20.3416	3.05774	
5564.97	20.4382	2.98179	
5654.98	20.5259	2.90722	
5746.44	20.6059	2.83406	
5839.39	20.6789	2.76230	
5933.83	20.7458	2.69197	
6029.81	20.8070	2.62301	
6127.33	20.8633	2.55550	
6226.44	20.9149	2.48934	
6327.15	20.9624	2.42460	
6429.48	21.0060	2.36120	
6533.48	21.0462	2.29916	
6639.15	21.0830	2.23843	
6746.54	21.1169	2.17910	
6855.65	21.1480	2.12111	
6966.54	21.1766	2.06435	
7079.22	21.2028	2.00893	
7193.72	21.2267	1.95474	
7310.07	21.2486	1.90184	
7428.31	21.2685	1.85021	
7548.45	21.2867	1.79973	
7670.54	21.3032	1.75051	
7794.61	21.3182	1.70247	
7920.68	21.3317	1.65552	
8048.79	21.3437	1.60978	
8178.98	21.3546	1.56514	
8311.26	21.3643	1.52157	
8445.69	21.3727	1.47910	
8582.29	21.3802	1.43775	
8721.11	21.3868	1.39737	
8862.16	21.3923	1.35800	
9005.50	21.3971	1.31974	
9151.16	21.4010	1.28234	
9299.17	21.4042	1.24595	
9449.58	21.4067	1.21053	
9602.42	21.4085	1.17600	
9757.73	21.4098	1.14241	
9915.55	21.4105	1.10962	
10075.9	21.4106	1.07774	
10238.9	21.4102	1.04671	
10404.5	21.4094	1.01650	
10572.8	21.4082	0.987098	
10743.8	21.4065	0.958486	
10917.6	21.4045	0.930645	
11094.2	21.4021	0.903557	
11273.6	21.3995	0.877203	
11455.9	21.3965	0.851568	
11641.2	21.3933	0.826633	
11829.5	21.3898	0.802382	
12020.8	21.3861	0.778799	
12215.3	21.3822	0.755866	
12412.8	21.3781	0.733569	
12613.6	21.3738	0.711891	
12817.6	21.3694	0.690817	
13025.0	21.3648	0.670332	
13235.6	21.3601	0.650421	
13449.7	21.3553	0.631070	
13667.2	21.3504	0.612264	
13888.3	21.3453	0.593990	
14112.9	21.3402	0.576232	
14341.2	21.3351	0.558980	
14573.1	21.3299	0.542218	
14808.9	21.3246	0.525936	
15048.4	21.3193	0.510118	
15291.8	21.3139	0.494755	
15539.1	21.3086	0.479833	
15790.4	21.3032	0.465340	
16045.8	21.2978	0.451266	
16305.4	21.2924	0.437599	
16569.1	21.2870	0.424328	
16837.1	21.2816	0.411443	
17109.4	21.2762	0.398932	
17386.1	21.2708	0.386787	
17667.4	21.2655	0.374996	
17953.1	21.2602	0.363550	
18243.5	21.2549	0.352440	
18538.6	21.2496	0.341656	
18838.4	21.2444	0.331189	
19143.1	21.2392	0.321031	
19452.7	21.2341	0.311173	
19767.4	21.2290	0.301607	
20087.1	21.2240	0.292323	
20412.0	21.2190	0.283316	
20742.1	21.2140	0.274576	
21077.6	21.2091	0.266095	
21418.5	21.2043	0.257868	
21765.0	21.1995	0.249887	
22117.0	21.1948	0.242144	
22474.7	21.1901	0.234633	
22838.2	21.1855	0.227347	
23207.6	21.1810	0.220280	
23583.0	21.1765	0.213425	
23964.4	21.1721	0.206777	
24352.0	21.1677	0.200329	
24745.9	21.1634	0.194075	
25146.2	21.1592	0.188011	
25552.9	21.1550	0.182130	
25966.2	21.1509	0.176428	
26386.1	21.1469	0.170898	
26812.9	21.1429	0.165537	
27246.6	21.1390	0.160338	
27687.3	21.1351	0.155298	
28135.1	21.1314	0.150412	
28590.2	21.1277	0.145674	
29052.6	21.1241	0.141082	
29522.5	21.1209	0.136630	
30000.0	21.1157	0.132314