cosio_heidi

Fit result

Overall status	Success
time	0.019 s
iterations	4
reduced χ²	2.21
wR(F²)	8.38 %

Fitted parameters

#	datablock	category	entry	parameter	units	start	value	s.u.	change
1	cosio_300k	atom_site	Co2	fract_x		0.276559	0.27656	0.00010
2	cosio_300k	atom_site	Co2	fract_z		0.991329	0.99133	0.00019
3	cosio_300k	atom_site	Si	fract_x		0.0948752	0.09488	0.00006
4	cosio_300k	atom_site	Si	fract_z		0.428146	0.42815	0.00010
5	cosio_300k	atom_site	O1	fract_x		0.0920617	0.09206	0.00005
6	cosio_300k	atom_site	O1	fract_z		0.767087	0.76709	0.00008
7	cosio_300k	atom_site	O2	fract_x		0.448692	0.44869	0.00004
8	cosio_300k	atom_site	O2	fract_z		0.215555	0.21555	0.00009
9	cosio_300k	atom_site	O3	fract_x		0.164189	0.16419	0.00003
10	cosio_300k	atom_site	O3	fract_y		0.0336017	0.03360	0.00005
11	cosio_300k	atom_site	O3	fract_z		0.281705	0.28170	0.00006
12	cosio_300k	atom_site_aniso	Co1	adp_11	Å²	0.00670212	0.0067	0.0003
13	cosio_300k	atom_site_aniso	Co1	adp_22	Å²	0.00411986	0.0041	0.0003
14	cosio_300k	atom_site_aniso	Co1	adp_33	Å²	0.00410235	0.00410	0.00019
15	cosio_300k	atom_site_aniso	Co1	adp_12	Å²	-8.96×10⁻⁴	-9×10⁻⁴	2×10⁻⁴
16	cosio_300k	atom_site_aniso	Co1	adp_13	Å²	8.15×10⁻⁵	8×10⁻⁵	18×10⁻⁵
17	cosio_300k	atom_site_aniso	Co1	adp_23	Å²	-5.13×10⁻⁴	-5.1×10⁻⁴	1.9×10⁻⁴
18	cosio_300k	atom_site_aniso	Co2	adp_11	Å²	0.00446678	0.0045	0.0003
19	cosio_300k	atom_site_aniso	Co2	adp_22	Å²	0.00538955	0.0054	0.0003
20	cosio_300k	atom_site_aniso	Co2	adp_33	Å²	0.00524024	0.0052	0.0003
21	cosio_300k	atom_site_aniso	Co2	adp_13	Å²	2.93×10⁻⁴	3×10⁻⁴	2×10⁻⁴
22	cosio_300k	atom_site_aniso	Si	adp_11	Å²	0.00386298	0.00386	0.00015
23	cosio_300k	atom_site_aniso	Si	adp_22	Å²	0.00396167	0.00396	0.00014
24	cosio_300k	atom_site_aniso	Si	adp_33	Å²	0.00278509	0.00279	0.00012
25	cosio_300k	atom_site_aniso	Si	adp_13	Å²	1.84×10⁻⁴	1.8×10⁻⁴	1.1×10⁻⁴
26	cosio_300k	atom_site_aniso	O1	adp_11	Å²	0.00638426	0.00638	0.00012
27	cosio_300k	atom_site_aniso	O1	adp_22	Å²	0.00585751	0.00586	0.00011
28	cosio_300k	atom_site_aniso	O1	adp_33	Å²	0.00307303	0.00307	0.00009
29	cosio_300k	atom_site_aniso	O1	adp_13	Å²	3.84×10⁻⁵	4×10⁻⁵	8×10⁻⁵
30	cosio_300k	atom_site_aniso	O2	adp_11	Å²	0.0041305	0.00413	0.00011
31	cosio_300k	atom_site_aniso	O2	adp_22	Å²	0.00642389	0.00642	0.00011
32	cosio_300k	atom_site_aniso	O2	adp_33	Å²	0.0049433	0.00494	0.00010
33	cosio_300k	atom_site_aniso	O2	adp_13	Å²	2.49×10⁻⁵	2×10⁻⁵	9×10⁻⁵
34	cosio_300k	atom_site_aniso	O3	adp_11	Å²	0.00713619	0.00714	0.00009
35	cosio_300k	atom_site_aniso	O3	adp_22	Å²	0.00536486	0.00536	0.00008
36	cosio_300k	atom_site_aniso	O3	adp_33	Å²	0.00520424	0.00520	0.00007
37	cosio_300k	atom_site_aniso	O3	adp_12	Å²	0.00189728	0.00190	0.00007
38	cosio_300k	atom_site_aniso	O3	adp_13	Å²	2.39×10⁻⁴	2.4×10⁻⁴	0.7×10⁻⁴
39	cosio_300k	atom_site_aniso	O3	adp_23	Å²	-3.57×10⁻⁴	-3.6×10⁻⁴	0.6×10⁻⁴
40	heidi_300k	linked_structure	cosio_300k	scale		18.7378	18.74	0.09
41	heidi_300k	extinction		coefficient_11		0.117024	0.117	0.014
42	heidi_300k	extinction		coefficient_22		0.28254	0.283	0.016
43	heidi_300k	extinction		coefficient_33		1.15547	1.16	0.08
44	heidi_300k	extinction		coefficient_12		-0.0762841	-0.08	0.04
45	heidi_300k	extinction		coefficient_13		-0.100319	-0.10	0.06
46	heidi_300k	extinction		coefficient_23		0.143178	0.14	0.12
47	heidi_55k	linked_structure	cosio_55k	scale		10	15.62	0.04	56.2% ↑

startthe value before the fit
valuethe fitted value
s.u.its standard uncertainty
changehow far the fit moved it, in % of the start: ↑ up, ↓ down