gd.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.	2.08082	
10.1617	-9999.	1.95184	
10.3261	-9999.	1.83085	
10.4931	-9999.	1.71736	
10.6628	-9999.	1.61441	
10.8353	-9999.	1.55876	
11.0106	-9999.	1.50503	
11.1886	-9999.	1.45051	
11.3696	-9999.	1.39724	
11.5535	-9999.	1.34593	
11.7404	-9999.	1.29650	
11.9303	-9999.	1.24889	
12.1232	-9999.	1.21967	
12.3193	-9999.	1.20557	
12.5186	-9999.	1.19164	
12.7210	-9999.	1.17786	
12.9268	-9999.	1.16425	
13.1359	-9999.	1.16057	
13.3483	-9999.	1.16657	
13.5642	-9999.	1.17260	
13.7836	-9999.	1.17867	
14.0066	-9999.	1.18476	
14.2331	-9999.	1.20099	
14.4633	-9999.	1.19353	
14.6973	-9999.	1.18611	
14.9350	-9999.	1.17874	
15.1765	-9999.	1.17142	
15.4220	-9999.	1.16565	
15.6714	-9999.	1.16015	
15.9249	-9999.	1.15468	
16.1825	-9999.	1.14924	
16.4442	-9999.	1.14382	
16.7102	-9999.	1.13842	
16.9805	-9999.	1.14709	
17.2551	-9999.	1.15990	
17.5342	-9999.	1.17285	
17.8178	-9999.	1.18594	
18.1060	-9999.	1.19919	
18.3989	-9999.	1.21310	
18.6964	-9999.	1.24435	
18.9988	-9999.	1.27640	
19.3061	-9999.	1.30927	
19.6184	-9999.	1.34532	
19.9357	-9999.	1.42138	
20.2582	-9999.	1.50173	
20.5858	-9999.	1.58663	
20.9188	-9999.	1.68236	
21.2571	-9999.	1.80173	
21.6009	-9999.	1.92956	
21.9503	-9999.	2.09847	
22.3053	-9999.	2.29089	
22.6661	-9999.	2.49294	
23.0327	-9999.	2.70543	
23.4053	-9999.	2.93604	
23.7838	-9999.	3.25803	
24.1685	-9999.	3.62622	
24.5594	-9999.	4.16607	
24.9566	-9999.	4.75364	
25.3603	-9999.	5.26298	
25.7705	-9999.	5.84591	
26.1873	-9999.	6.91208	
26.6109	-9999.	7.90552	
27.0413	-9999.	8.56029	
27.4786	-9999.	9.26928	
27.9231	-9999.	9.84883	
28.3747	-9999.	10.2852	
28.8337	-9999.	10.7408	
29.3000	1.61714	11.2166	
29.7739	2.25008	11.5635	
30.2555	2.82561	11.7878	
30.7449	3.36098	12.0164	
31.2421	3.90478	12.2494	
31.7475	4.49161	12.4870	
32.2609	5.21040	12.6664	
32.7827	5.91336	12.6181	
33.3130	6.47805	12.5699	
33.8518	7.03846	12.5220	
34.3993	7.63656	12.4490	
34.9557	8.21802	12.2756	
35.5211	8.79008	12.1046	
36.0956	9.39410	11.8322	
36.6794	9.89898	11.3706	
37.2727	10.2677	10.9089	
37.8755	10.5227	10.4057	
38.4882	10.6245	9.92566	
39.1107	10.6590	9.62909	
39.7432	10.7345	9.35283	
40.3861	10.7938	9.08450	
41.0393	10.8369	8.84579	
41.7031	10.8760	8.61653	
42.3776	10.8884	8.39321	
43.0630	10.8756	8.21373	
43.7595	10.8708	8.06293	
44.4673	10.8700	7.91489	
45.1865	10.8539	7.77724	
45.9174	10.8393	7.68139	
46.6600	10.8413	7.58672	
47.4147	10.8465	7.49322	
48.1816	10.8512	7.40087	
48.9609	10.8519	7.30966	
49.7528	10.8480	7.22189	
50.5576	10.8395	7.13571	
51.3753	10.8226	7.05057	
52.2062	10.7925	6.96644	
53.0506	10.7315	6.88331	
53.9087	10.6567	6.87159	
54.7806	10.6165	6.87255	
55.6667	10.5931	6.87350	
56.5670	10.5766	6.87446	
57.4820	10.5638	6.87542	
58.4117	10.5510	6.87637	
59.3564	10.5395	6.88692	
60.3165	10.5347	6.89812	
61.2921	10.5327	6.90935	
62.2834	10.5321	6.92059	
63.2908	10.5318	6.93185	
64.3145	10.5300	6.94312	
65.3547	10.5272	6.95944	
66.4118	10.5265	6.97691	
67.4859	10.5262	6.99441	
68.5775	10.5247	7.01197	
69.6867	10.5208	7.02956	
70.8138	10.5116	7.04720	
71.9591	10.4922	7.07401	
73.1230	10.4769	7.11892	
74.3057	10.4744	7.16412	
75.5076	10.4754	7.20960	
76.7289	10.4797	7.25538	
77.9699	10.4874	7.30144	
79.2310	10.5041	7.34780	
80.5125	10.5288	7.38400	
81.8147	10.5424	7.39458	
83.1380	10.5366	7.41089	
84.4827	10.5265	7.43971	
85.8491	10.5172	7.46864	
87.2377	10.5054	7.49768	
88.6487	10.4906	7.52684	
90.0825	10.4724	7.55612	
91.5395	10.4509	7.58550	
93.0201	10.4258	7.61294	
94.5246	10.3945	7.63888	
96.0535	10.3564	7.66491	
97.6071	10.3120	7.69103	
99.1858	10.2610	7.71724	
100.790	10.2034	7.74354	
102.420	10.1396	7.76993	
104.077	10.0731	7.79640	
105.760	10.0048	7.80766	
107.471	9.91759	7.80415	
109.209	9.80847	7.80065	
110.975	9.69292	7.79715	
112.770	9.57775	7.76001	
114.594	9.41891	7.67835	
116.448	9.23473	7.59757	
118.331	9.01946	7.43854	
120.245	8.68793	7.18519	
122.190	8.20607	6.90143	
124.166	7.54570	6.60975	
126.175	6.70058	6.32999	
128.215	5.63631	6.06207	
130.289	4.28758	5.80550	
132.397	2.53971	5.56657	
134.538	0.207075	5.35179	
136.714	-3.39847	5.27329	
138.925	-8.66782	5.84978	
141.172	-16.4319	10.3240	
143.456	-25.7377	19.1704	
145.776	-31.4923	40.4382	
148.134	-8.67966	79.0764	
150.530	28.2039	58.4450	
152.964	34.0959	40.5585	
155.439	32.2495	29.8237	
157.953	28.4436	24.6593	
160.507	26.2653	23.0483	
163.103	25.0742	21.8142	
165.742	24.4024	21.2364	
168.422	24.1813	20.6677	
171.146	24.1129	20.0737	
173.915	24.0788	19.4967	
176.727	24.0215	18.9810	
179.586	24.0014	18.5924	
182.491	24.0667	18.2117	
185.442	24.1443	17.8388	
188.442	24.2259	17.4736	
191.489	24.3021	17.1158	
194.587	24.3649	16.7654	
197.734	24.4079	16.4221	
200.932	24.3633	16.0859	
204.182	24.2979	15.9096	
207.485	24.3405	15.7464	
210.840	24.3952	15.5848	
214.251	24.4609	15.4248	
217.716	24.5319	15.2665	
221.237	24.6035	15.1099	
224.816	24.6695	14.9548	
228.452	24.7226	14.8161	
232.147	24.7832	14.7047	
235.902	24.8625	14.5940	
239.717	24.9452	14.4843	
243.595	25.0303	14.3753	
247.535	25.1161	14.2672	
251.538	25.2007	14.1598	
255.607	25.2834	14.0550	
259.741	25.3654	13.9532	
263.942	25.4463	13.8522	
268.211	25.5246	13.7518	
272.549	25.5991	13.6523	
276.957	25.6687	13.5534	
281.437	25.7316	13.4553	
285.989	25.7852	13.3578	
290.615	25.8228	13.2611	
295.315	25.8311	13.1850	
300.092	25.8445	13.1589	
304.945	25.8884	13.1329	
309.878	25.9347	13.1068	
314.890	25.9789	13.0809	
319.983	26.0050	13.0550	
325.158	26.0249	13.0969	
330.418	26.0927	13.1473	
335.762	26.1981	13.1978	
341.192	26.3269	13.2203	
346.711	26.4464	13.2179	
352.319	26.5593	13.2155	
358.017	26.6715	13.2131	
363.808	26.7843	13.2107	
369.692	26.8986	13.2083	
375.672	27.0149	13.2059	
381.748	27.1337	13.2035	
387.922	27.2560	13.2010	
394.197	27.3891	13.1983	
400.573	27.5240	13.1737	
407.052	27.6450	13.1491	
413.635	27.7633	13.1245	
420.326	27.8786	13.1000	
427.124	27.9911	13.0756	
434.032	28.1003	13.0511	
441.052	28.2057	13.0268	
448.186	28.2930	13.0025	
455.435	28.3752	13.0113	
462.802	28.4847	13.0289	
470.287	28.6049	13.0466	
477.894	28.7360	13.0643	
485.623	28.8787	13.0820	
493.478	29.0595	13.0997	
501.459	29.2551	13.0561	
509.570	29.4066	12.9981	
517.812	29.5480	12.9404	
526.187	29.6817	12.8829	
534.698	29.8103	12.8257	
543.346	29.9353	12.7688	
552.134	30.0586	12.7121	
561.065	30.1844	12.6556	
570.139	30.3174	12.5980	
579.361	30.4494	12.5046	
588.732	30.5595	12.4110	
598.254	30.6585	12.3174	
607.930	30.7493	12.2245	
617.763	30.8347	12.1324	
627.755	30.9167	12.0402	
637.908	30.9995	11.9388	
648.226	31.0727	11.8237	
658.711	31.1227	11.7003	
669.365	31.1510	11.5783	
680.191	31.1598	11.4758	
691.193	31.1702	11.3879	
702.372	31.1933	11.3032	
713.733	31.2173	11.2004	
725.277	31.2208	11.0857	
737.008	31.2086	10.9724	
748.928	31.1840	10.8601	
761.042	31.1476	10.7487	
773.351	31.1020	10.6367	
785.859	31.0440	10.5192	
798.570	30.9661	10.3977	
811.486	30.8693	10.2777	
824.611	30.7545	10.1590	
837.949	30.6210	10.0415	
851.502	30.4684	9.92374	
865.274	30.2935	9.80533	
879.269	30.0928	9.68655	
893.491	29.8647	9.56910	
907.943	29.6071	9.45308	
922.628	29.3180	9.33848	
937.551	28.9926	9.21895	
952.715	28.6213	9.09921	
968.124	28.1979	8.97950	
983.783	27.7155	8.86170	
999.695	27.1650	8.74463	
1015.86	26.5329	8.62824	
1032.29	25.7998	8.50656	
1048.99	24.9364	8.38533	
1065.96	23.9079	8.26456	
1083.20	22.6611	8.14550	
1100.72	21.1120	8.02816	
1118.52	19.1152	7.91251	
1136.61	16.3888	7.79868	
1155.	12.2664	7.68644	
1173.68	4.38473	7.57573	
1189.50	-50.9821	7.48456	
1189.70	-50.9570	42.3406	
1192.66	-12.7603	42.1966	
1211.95	10.1739	41.2793	
1231.55	17.7389	40.3820	
1251.47	22.4771	39.5065	
1271.72	25.9380	38.6533	
1292.29	28.6560	37.8223	
1313.19	30.8796	37.0092	
1334.43	32.7423	36.2135	
1356.01	34.3250	35.4348	
1377.94	35.6789	34.6727	
1400.23	36.8359	33.9271	
1422.88	37.8138	33.1974	
1445.89	38.6179	32.4837	
1469.28	39.2321	31.7827	
1493.04	39.6038	31.0928	
1517.19	39.6186	30.4023	
1541.73	36.6250	29.7251	
1543.90	32.7823	29.6664	
1544.10	32.8061	34.2371	
1566.67	40.6907	33.6129	
1592.01	42.3335	32.9358	
1617.76	43.4144	32.2723	
1643.92	43.7584	31.6220	
1670.51	43.9654	32.1788	
1688.20	45.0624	32.5496	
1688.40	45.0902	32.6806	
1697.53	45.8366	32.4414	
1724.99	47.1124	31.7399	
1752.89	48.0608	31.0536	
1781.24	48.8386	30.3820	
1810.05	49.4808	29.7243	
1839.32	49.9724	29.0812	
1869.07	50.1184	28.4522	
1880.70	48.4670	28.2127	
1880.90	48.4714	29.4562	
1899.30	50.9058	29.0700	
1930.02	51.8421	28.4445	
1961.24	52.5400	27.8325	
1992.96	53.1353	27.2335	
2025.20	53.6693	26.6561	
2057.95	54.1618	26.0788	
2091.24	54.6076	25.5111	
2125.06	55.0180	24.9546	
2159.43	55.3972	24.4086	
2194.36	55.7484	23.8730	
2229.85	56.0743	23.3478	
2265.92	56.3771	22.8328	
2302.57	56.6584	22.3283	
2339.81	56.9202	21.8331	
2377.66	57.1638	21.3496	
2416.11	57.3910	20.8740	
2455.19	57.6017	20.4093	
2494.90	57.7985	19.9523	
2535.26	57.9798	19.5064	
2576.26	58.1489	19.0687	
2617.93	58.3051	18.6398	
2660.27	58.4490	18.2205	
2703.30	58.5832	17.8107	
2747.03	58.7071	17.4079	
2791.46	58.8202	17.0139	
2836.61	58.9241	16.6283	
2882.49	59.0188	16.2510	
2929.11	59.1055	15.8823	
2976.48	59.1844	15.5207	
3024.63	59.2554	15.1669	
3073.55	59.3192	14.8209	
3123.26	59.3763	14.4820	
3173.78	59.4262	14.1500	
3225.11	59.4693	13.8261	
3277.27	59.5077	13.5092	
3330.28	59.5400	13.1982	
3384.15	59.5663	12.8943	
3438.88	59.5871	12.5971	
3494.50	59.6031	12.3065	
3551.02	59.6140	12.0221	
3608.46	59.6202	11.7439	
3666.82	59.6217	11.4718	
3726.13	59.6188	11.2056	
3786.40	59.6114	10.9452	
3847.64	59.5997	10.6905	
3909.87	59.5839	10.4415	
3973.11	59.5642	10.1980	
4037.38	59.5403	9.95962	
4102.68	59.5125	9.72657	
4169.03	59.4807	9.49859	
4236.46	59.4449	9.27565	
4304.98	59.4053	9.05766	
4374.62	59.3617	8.84453	
4445.37	59.3143	8.63594	
4517.27	59.2627	8.43192	
4590.33	59.2070	8.23247	
4664.58	59.1471	8.03739	
4740.03	59.0828	7.84656	
4816.69	59.0140	7.65993	
4894.60	58.9405	7.47742	
4973.77	58.8620	7.29889	
5054.21	58.7782	7.12426	
5135.96	58.6889	6.95345	
5219.03	58.5934	6.78638	
5303.44	58.4915	6.62317	
5389.22	58.3826	6.46343	
5476.39	58.2660	6.30704	
5564.97	58.1407	6.15433	
5654.98	58.0061	6.00451	
5746.44	57.8604	5.85833	
5839.39	57.7028	5.71526	
5933.83	57.5312	5.57525	
6029.81	57.3433	5.43840	
6127.33	57.1363	5.30452	
6226.44	56.9066	5.17352	
6327.15	56.6490	5.04537	
6429.48	56.3568	4.92003	
6533.48	56.0200	4.79726	
6639.15	55.6238	4.67723	
6746.54	55.1447	4.55972	
6855.65	54.5406	4.44486	
6966.54	53.7261	4.33248	
7079.22	52.4742	4.22248	
7193.72	49.6320	4.11493	
7242.70	34.9712	4.07027	
7242.90	34.9728	11.5429	
7310.07	50.4736	11.3460	
7428.31	52.7873	11.0117	
7548.45	53.7385	10.6875	
7670.54	54.1252	10.3725	
7794.61	53.9646	10.0670	
7920.68	51.2168	9.77051	
7930.20	45.6221	9.74865	
7930.40	45.6233	13.6270	
8048.79	54.7086	13.2418	
8178.98	55.7713	12.8369	
8311.26	56.0165	12.4442	
8375.50	52.7709	12.2600	
8375.70	52.7735	14.0470	
8445.69	56.7057	13.8757	
8582.29	57.8654	13.5512	
8721.11	58.6277	13.2322	
8862.16	59.2326	12.9188	
9005.50	59.7415	12.6107	
9151.16	60.1816	12.3079	
9299.17	60.5686	12.0108	
9449.58	60.9131	11.7195	
9602.42	61.2224	11.4337	
9757.73	61.5011	11.1533	
9915.55	61.7537	10.8789	
10075.9	61.9839	10.6094	
10238.9	62.1930	10.3454	
10404.5	62.3839	10.0868	
10572.8	62.5584	9.83363	
10743.8	62.7180	9.58574	
10917.6	62.8639	9.34313	
11094.2	62.9975	9.10575	
11273.6	63.1197	8.87352	
11455.9	63.2314	8.64641	
11641.2	63.3335	8.42435	
11829.5	63.4266	8.20725	
12020.8	63.5115	7.99507	
12215.3	63.5887	7.78772	
12412.8	63.6587	7.58514	
12613.6	63.7222	7.38725	
12817.6	63.7794	7.19399	
13025.0	63.8310	7.00527	
13235.6	63.8771	6.82102	
13449.7	63.9182	6.64116	
13667.2	63.9547	6.46561	
13888.3	63.9868	6.29430	
14112.9	64.0147	6.12715	
14341.2	64.0389	5.96408	
14573.1	64.0594	5.80501	
14808.9	64.0767	5.64986	
15048.4	64.0908	5.49856	
15291.8	64.1019	5.35103	
15539.1	64.1103	5.20720	
15790.4	64.1162	5.06698	
16045.8	64.1196	4.93030	
16305.4	64.1208	4.79709	
16569.1	64.1199	4.66727	
16837.1	64.1170	4.54077	
17109.4	64.1123	4.41752	
17386.1	64.1059	4.29744	
17667.4	64.0979	4.18046	
17953.1	64.0884	4.06651	
18243.5	64.0775	3.95553	
18538.6	64.0653	3.84744	
18838.4	64.0518	3.74219	
19143.1	64.0373	3.63969	
19452.7	64.0217	3.53990	
19767.4	64.0051	3.44274	
20087.1	63.9875	3.34815	
20412.0	63.9692	3.25607	
20742.1	63.9500	3.16643	
21077.6	63.9301	3.07919	
21418.5	63.9095	2.99428	
21765.0	63.8882	2.91164	
22117.0	63.8664	2.83122	
22474.7	63.8440	2.75297	
22838.2	63.8211	2.67681	
23207.6	63.7977	2.60272	
23583.0	63.7738	2.53063	
23964.4	63.7495	2.46049	
24352.0	63.7248	2.39226	
24745.9	63.6997	2.32588	
25146.2	63.6742	2.26131	
25552.9	63.6483	2.19849	
25966.2	63.6222	2.13740	
26386.1	63.5956	2.07797	
26812.9	63.5688	2.02017	
27246.6	63.5416	1.96395	
27687.3	63.5141	1.90928	
28135.1	63.4863	1.85611	
28590.2	63.4581	1.80440	
29052.6	63.4296	1.75412	
29522.5	63.4008	1.70522	
30000.0	63.3715	1.65767