sr.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.	0.171262	
10.1617	-9999.	0.174896	
10.3261	-9999.	0.178608	
10.4931	-9999.	0.182398	
10.6628	-9999.	0.186269	
10.8353	-9999.	0.190614	
11.0106	-9999.	0.195136	
11.1886	-9999.	0.199766	
11.3696	-9999.	0.204505	
11.5535	-9999.	0.209357	
11.7404	-9999.	0.214324	
11.9303	-9999.	0.219410	
12.1232	-9999.	0.225385	
12.3193	-9999.	0.231522	
12.5186	-9999.	0.237827	
12.7210	-9999.	0.244303	
12.9268	-9999.	0.250955	
13.1359	-9999.	0.258014	
13.3483	-9999.	0.266925	
13.5642	-9999.	0.276144	
13.7836	-9999.	0.285681	
14.0066	-9999.	0.295547	
14.2331	-9999.	0.305755	
14.4633	-9999.	0.316410	
14.6973	-9999.	0.329067	
14.9350	-9999.	0.342230	
15.1765	-9999.	0.355920	
15.4220	-9999.	0.370157	
15.6714	-9999.	0.384964	
15.9249	-9999.	0.400363	
16.1825	-9999.	0.416922	
16.4442	-9999.	0.434177	
16.7102	-9999.	0.452147	
16.9805	-9999.	0.470860	
17.2551	-9999.	0.490347	
17.5342	-9999.	0.510641	
17.8178	-9999.	0.532703	
18.1060	-9999.	0.560547	
18.3989	-9999.	0.589847	
18.6964	-9999.	0.620679	
18.9988	-9999.	0.653122	
19.3061	-9999.	0.687261	
19.6184	-9999.	0.723863	
19.9357	-9999.	0.769653	
20.2582	-9999.	0.818341	
20.5858	-9999.	0.870107	
20.9188	-9999.	0.925148	
21.2571	-9999.	0.983672	
21.6009	-9999.	1.06431	
21.9503	-9999.	1.16788	
22.3053	-9999.	1.28153	
22.6661	-9999.	2.58184	
23.0327	-9999.	5.67161	
23.4053	-9999.	12.3368	
23.7838	-9999.	13.4118	
24.1685	-9999.	14.5585	
24.5594	-9999.	15.7782	
24.9566	-9999.	16.8964	
25.3603	-9999.	17.7614	
25.7705	-9999.	18.6706	
26.1873	-9999.	19.2298	
26.6109	-9999.	19.7747	
27.0413	-9999.	20.3350	
27.4786	-9999.	20.4560	
27.9231	-9999.	20.3882	
28.3747	-9999.	20.3207	
28.8337	-9999.	20.0875	
29.3000	5.58141	19.7809	
29.7739	6.60730	19.4790	
30.2555	7.63084	19.1817	
30.7449	8.77090	18.7445	
31.2421	9.69125	18.0643	
31.7475	10.4429	17.4087	
32.2609	11.0918	16.7769	
32.7827	11.6698	16.1681	
33.3130	12.1950	15.5813	
33.8518	12.6843	15.0159	
34.3993	13.1613	14.4709	
34.9557	13.6862	13.9292	
35.5211	14.1362	13.1751	
36.0956	14.4427	12.4618	
36.6794	14.6643	11.7872	
37.2727	14.8303	11.1491	
37.8755	14.9522	10.5455	
38.4882	15.0386	9.97465	
39.1107	15.0958	9.43467	
39.7432	15.1291	8.92392	
40.3861	15.1431	8.44081	
41.0393	15.1421	7.98386	
41.7031	15.1304	7.55165	
42.3776	15.1160	7.14284	
43.0630	15.1154	6.75616	
43.7595	15.1207	6.31630	
44.4673	15.0583	5.87774	
45.1865	14.9620	5.46965	
45.9174	14.8447	5.08988	
46.6600	14.7127	4.73648	
47.4147	14.5698	4.40762	
48.1816	14.4189	4.10159	
48.9609	14.2619	3.81682	
49.7528	14.1006	3.55181	
50.5576	13.9359	3.30520	
51.3753	13.7683	3.07572	
52.2062	13.5982	2.86507	
53.0506	13.4305	2.67044	
53.9087	13.2643	2.48903	
54.7806	13.0991	2.31994	
55.6667	12.9350	2.16233	
56.5670	12.7720	2.01544	
57.4820	12.6102	1.87852	
58.4117	12.4493	1.75091	
59.3564	12.2889	1.63196	
60.3165	12.1294	1.52330	
61.2921	11.9724	1.42235	
62.2834	11.8166	1.32810	
63.2908	11.6612	1.24010	
64.3145	11.5054	1.15792	
65.3547	11.3472	1.08119	
66.4118	11.1805	1.00955	
67.4859	11.0136	0.969212	
68.5775	10.8617	0.934670	
69.6867	10.7174	0.901357	
70.8138	10.5746	0.869234	
71.9591	10.4313	0.842044	
73.1230	10.2820	0.823873	
74.3057	10.1443	0.817443	
75.5076	10.0094	0.811064	
76.7289	9.87887	0.816739	
77.9699	9.75628	0.823115	
79.2310	9.63849	0.829541	
80.5125	9.52258	0.836017	
81.8147	9.40891	0.845842	
83.1380	9.29799	0.855911	
84.4827	9.18864	0.866099	
85.8491	9.07960	0.876409	
87.2377	8.96870	0.887895	
88.6487	8.85941	0.903027	
90.0825	8.75147	0.918415	
91.5395	8.64363	0.934067	
93.0201	8.53538	0.949985	
94.5246	8.42636	0.966175	
96.0535	8.31675	0.982639	
97.6071	8.20536	0.997154	
99.1858	8.09019	1.01132	
100.790	7.97126	1.02569	
102.420	7.84816	1.04026	
104.077	7.72030	1.05505	
105.760	7.58691	1.07004	
107.471	7.44686	1.08524	
109.209	7.29903	1.10190	
110.975	7.14368	1.11954	
112.770	6.97897	1.13746	
114.594	6.80222	1.15567	
116.448	6.60827	1.17417	
118.331	6.39577	1.20264	
120.245	6.16448	1.23546	
122.190	5.91059	1.28442	
124.166	5.62348	1.33915	
126.175	5.29974	1.44541	
128.215	4.90059	1.57652	
130.289	4.60439	1.99485	
132.397	4.56325	2.21466	
134.538	4.37806	2.28553	
136.714	4.07743	2.41905	
138.925	3.71998	2.57557	
141.172	3.34108	2.86818	
143.456	2.97861	3.20328	
145.776	2.61650	3.62092	
148.134	2.32405	4.12550	
150.530	2.12973	4.62736	
152.964	1.93804	5.13125	
155.439	1.77018	5.68999	
157.953	1.69456	6.30959	
160.507	1.72149	6.83708	
163.103	1.72234	7.33910	
165.742	1.72733	7.87796	
168.422	1.82247	8.41780	
171.146	1.89822	8.89448	
173.915	1.97473	9.39816	
176.727	2.08111	9.93035	
179.586	2.27211	10.4927	
182.491	2.49029	10.9233	
185.442	2.68376	11.3608	
188.442	2.87596	11.8157	
191.489	3.11275	12.2889	
194.587	3.36572	12.6906	
197.734	3.60571	13.0968	
200.932	3.85244	13.5161	
204.182	4.11125	13.9288	
207.485	4.38289	14.3528	
210.840	4.68302	14.7898	
214.251	5.07149	15.2400	
217.716	5.46285	15.5540	
221.237	5.81390	15.8709	
224.816	6.15796	16.1942	
228.452	6.50922	16.5241	
232.147	6.89036	16.8511	
235.902	7.26412	17.1427	
239.717	7.63325	17.4393	
243.595	8.00630	17.7410	
247.535	8.38948	18.0480	
251.538	8.78673	18.3602	
255.607	9.20100	18.6789	
259.741	9.64337	19.0088	
263.942	10.1235	19.3444	
268.211	10.6582	19.6860	
272.549	11.3146	20.0229	
276.957	11.9672	20.1598	
281.437	12.5906	20.2977	
285.989	13.2334	20.4364	
290.615	14.0056	20.4847	
295.315	14.6405	20.3331	
300.092	15.1737	20.1826	
304.945	15.6327	20.0332	
309.878	16.0272	19.9267	
314.890	16.4314	19.8652	
319.983	16.8373	19.8038	
325.158	17.2385	19.7428	
330.418	17.6346	19.6821	
335.762	18.0262	19.6215	
341.192	18.4138	19.5610	
346.711	18.7988	19.5008	
352.319	19.1826	19.4408	
358.017	19.5664	19.3808	
363.808	19.9521	19.3209	
369.692	20.3424	19.2612	
375.672	20.7408	19.2016	
381.748	21.1555	19.1424	
387.922	21.6053	19.0674	
394.197	22.0816	18.9573	
400.573	22.5518	18.7584	
407.052	22.9583	18.5266	
413.635	23.3271	18.2977	
420.326	23.6718	18.0717	
427.124	23.9986	17.8485	
434.032	24.3106	17.6276	
441.052	24.6107	17.4097	
448.186	24.9071	17.1928	
455.435	25.1924	16.9694	
462.802	25.4653	16.7419	
470.287	25.7235	16.5139	
477.894	25.9699	16.2899	
485.623	26.2072	16.0682	
493.478	26.4361	15.8493	
501.459	26.6580	15.6334	
509.570	26.8746	15.4206	
517.812	27.0894	15.2094	
526.187	27.3017	14.9961	
534.698	27.5082	14.7755	
543.346	27.7025	14.5532	
552.134	27.8907	14.3345	
561.065	28.0731	14.1104	
570.139	28.2444	13.8856	
579.361	28.4049	13.6640	
588.732	28.5581	13.4465	
598.254	28.7055	13.2328	
607.930	28.8485	13.0226	
617.763	28.9883	12.8156	
627.755	29.1294	12.6110	
637.908	29.2702	12.3991	
648.226	29.4042	12.1753	
658.711	29.5167	11.9455	
669.365	29.6073	11.7201	
680.191	29.6800	11.5229	
691.193	29.7612	11.3473	
702.372	29.8662	11.1775	
713.733	29.9787	10.9875	
725.277	30.0751	10.7852	
737.008	30.1603	10.5865	
748.928	30.2386	10.3916	
761.042	30.3123	10.2002	
773.351	30.3828	10.0109	
785.859	30.4496	9.82093	
798.570	30.5085	9.63106	
811.486	30.5610	9.44480	
824.611	30.6083	9.26218	
837.949	30.6515	9.08311	
851.502	30.6907	8.90671	
865.274	30.7260	8.73301	
879.269	30.7571	8.56208	
893.491	30.7843	8.39438	
907.943	30.8085	8.22998	
922.628	30.8312	8.06880	
937.551	30.8504	7.90588	
952.715	30.8648	7.74494	
968.124	30.8736	7.58616	
983.783	30.8779	7.43076	
999.695	30.8781	7.27860	
1015.86	30.8742	7.12964	
1032.29	30.8688	6.98536	
1048.99	30.8616	6.84129	
1065.96	30.8490	6.69726	
1083.20	30.8313	6.55634	
1100.72	30.8094	6.41842	
1118.52	30.7835	6.28342	
1136.61	30.7536	6.15110	
1155.	30.7197	6.02166	
1173.68	30.6822	5.89509	
1192.66	30.6408	5.77091	
1211.95	30.5954	5.64946	
1231.55	30.5470	5.53074	
1251.47	30.4951	5.41229	
1271.72	30.4385	5.29437	
1292.29	30.3746	5.17661	
1313.19	30.3037	5.06127	
1334.43	30.2258	4.94853	
1356.01	30.1410	4.83838	
1377.94	30.0489	4.73070	
1400.23	29.9491	4.62544	
1422.88	29.8410	4.52258	
1445.89	29.7237	4.42190	
1469.28	29.5963	4.32351	
1493.04	29.4578	4.22743	
1517.19	29.3069	4.13383	
1541.73	29.1421	4.04241	
1566.67	28.9615	3.95307	
1592.01	28.7625	3.86580	
1617.76	28.5422	3.78045	
1643.92	28.2964	3.69695	
1670.51	28.0198	3.61520	
1697.53	27.7056	3.53527	
1724.99	27.3422	3.45713	
1752.89	26.9184	3.38438	
1781.24	26.4154	3.31443	
1810.05	25.8000	3.24684	
1839.32	25.0138	3.18064	
1869.07	23.9363	3.11578	
1899.30	22.2438	3.05223	
1930.02	18.0503	2.98998	
1939.50	5.28010	2.97123	
1939.70	5.28403	11.7640	
1961.24	20.0566	11.4624	
1992.96	21.0943	11.0379	
2006.70	15.2358	10.8609	
2006.90	15.2501	15.1320	
2025.20	22.8854	14.9479	
2057.95	25.2033	14.6279	
2091.24	26.5585	14.3148	
2125.06	27.4987	14.0082	
2159.43	28.1344	13.7083	
2194.36	28.3227	13.4144	
2216.20	25.5952	13.2361	
2216.40	25.6051	15.2077	
2229.85	28.7670	15.0779	
2265.92	30.1929	14.7390	
2302.57	31.0805	14.4054	
2339.81	31.7865	14.0767	
2377.66	32.3848	13.7529	
2416.11	32.9074	13.4348	
2455.19	33.3715	13.1219	
2494.90	33.7884	12.8145	
2535.26	34.1654	12.5121	
2576.26	34.5082	12.2152	
2617.93	34.8211	11.9238	
2660.27	35.1081	11.6383	
2703.30	35.3718	11.3575	
2747.03	35.6143	11.0821	
2791.46	35.8373	10.8123	
2836.61	36.0434	10.5483	
2882.49	36.2339	10.2890	
2929.11	36.4097	10.0350	
2976.48	36.5718	9.78634	
3024.63	36.7218	9.54315	
3073.55	36.8604	9.30473	
3123.26	36.9884	9.07165	
3173.78	37.1064	8.84328	
3225.11	37.2152	8.62019	
3277.27	37.3154	8.40194	
3330.28	37.4079	8.18871	
3384.15	37.4929	7.98001	
3438.88	37.5709	7.77603	
3494.50	37.6422	7.57647	
3551.02	37.7072	7.38193	
3608.46	37.7668	7.19179	
3666.82	37.8210	7.00602	
3726.13	37.8701	6.82458	
3786.40	37.9145	6.64742	
3847.64	37.9544	6.47440	
3909.87	37.9901	6.30553	
3973.11	38.0218	6.14074	
4037.38	38.0499	5.97991	
4102.68	38.0746	5.82298	
4169.03	38.0959	5.66985	
4236.46	38.1142	5.52048	
4304.98	38.1297	5.37480	
4374.62	38.1424	5.23270	
4445.37	38.1527	5.09411	
4517.27	38.1605	4.95892	
4590.33	38.1660	4.82720	
4664.58	38.1696	4.69872	
4740.03	38.1711	4.57351	
4816.69	38.1707	4.45143	
4894.60	38.1687	4.33245	
4973.77	38.1650	4.21654	
5054.21	38.1598	4.10354	
5135.96	38.1532	3.99345	
5219.03	38.1452	3.88617	
5303.44	38.1360	3.78168	
5389.22	38.1256	3.67982	
5476.39	38.1141	3.58062	
5564.97	38.1017	3.48401	
5654.98	38.0882	3.38985	
5746.44	38.0738	3.29825	
5839.39	38.0586	3.20894	
5933.83	38.0426	3.12199	
6029.81	38.0259	3.03733	
6127.33	38.0085	2.95494	
6226.44	37.9905	2.87467	
6327.15	37.9719	2.79654	
6429.48	37.9527	2.72044	
6533.48	37.9330	2.64635	
6639.15	37.9129	2.57425	
6746.54	37.8923	2.50402	
6855.65	37.8712	2.43567	
6966.54	37.8497	2.36917	
7079.22	37.8279	2.30441	
7193.72	37.8056	2.24132	
7310.07	37.7831	2.18004	
7428.31	37.7602	2.12035	
7548.45	37.7370	2.06216	
7670.54	37.7135	2.00563	
7794.61	37.6897	1.95054	
7920.68	37.6655	1.89697	
8048.79	37.6411	1.84490	
8178.98	37.6165	1.79419	
8311.26	37.5916	1.74478	
8445.69	37.5663	1.69672	
8582.29	37.5407	1.64997	
8721.11	37.5148	1.60447	
8862.16	37.4886	1.56020	
9005.50	37.4621	1.51713	
9151.16	37.4352	1.47520	
9299.17	37.4079	1.43441	
9449.58	37.3803	1.39472	
9602.42	37.3522	1.35611	
9757.73	37.3236	1.31853	
9915.55	37.2945	1.28195	
10075.9	37.2648	1.24638	
10238.9	37.2345	1.21176	
10404.5	37.2036	1.17808	
10572.8	37.1719	1.14530	
10743.8	37.1394	1.11341	
10917.6	37.1059	1.08238	
11094.2	37.0715	1.05219	
11273.6	37.0359	1.02281	
11455.9	36.9990	0.994222	
11641.2	36.9607	0.966406	
11829.5	36.9208	0.939339	
12020.8	36.8791	0.913002	
12215.3	36.8352	0.887374	
12412.8	36.7890	0.862436	
12613.6	36.7399	0.838169	
12817.6	36.6877	0.814555	
13025.0	36.6316	0.791575	
13235.6	36.5711	0.769214	
13449.7	36.5053	0.747453	
13667.2	36.4329	0.726275	
13888.3	36.3526	0.705667	
14112.9	36.2622	0.685610	
14341.2	36.1589	0.666091	
14573.1	36.0385	0.647094	
14808.9	35.8946	0.628606	
15048.4	35.7164	0.610611	
15291.8	35.4841	0.593098	
15539.1	35.1551	0.576052	
15790.4	34.6058	0.559459	
16045.8	32.9628	0.543310	
16104.5	26.4571	0.539702	
16104.7	26.4573	3.75733	
16305.4	34.3200	3.68752	
16569.1	35.2344	3.59899	
16837.1	35.7413	3.51194	
17109.4	36.0956	3.42639	
17386.1	36.3681	3.34234	
17667.4	36.5889	3.25981	
17953.1	36.7737	3.17880	
18243.5	36.9318	3.09932	
18538.6	37.0692	3.02136	
18838.4	37.1900	2.94492	
19143.1	37.2972	2.87000	
19452.7	37.3930	2.79660	
19767.4	37.4790	2.72469	
20087.1	37.5566	2.65429	
20412.0	37.6268	2.58537	
20742.1	37.6906	2.51793	
21077.6	37.7486	2.45194	
21418.5	37.8014	2.38740	
21765.0	37.8496	2.32429	
22117.0	37.8936	2.26259	
22474.7	37.9338	2.20229	
22838.2	37.9705	2.14336	
23207.6	38.0040	2.08580	
23583.0	38.0346	2.02957	
23964.4	38.0625	1.97466	
24352.0	38.0880	1.92105	
24745.9	38.1112	1.86873	
25146.2	38.1323	1.81766	
25552.9	38.1514	1.76782	
25966.2	38.1687	1.71920	
26386.1	38.1843	1.67178	
26812.9	38.1984	1.62553	
27246.6	38.2110	1.58043	
27687.3	38.2223	1.53645	
28135.1	38.2324	1.49359	
28590.2	38.2413	1.45181	
29052.6	38.2494	1.41109	
29522.5	38.2602	1.37142	
30000.0	38.2499	1.33276