Co₂SiO₄ [Pnma.1]

Fit result

Overall status	Success
time	0.28 s
iterations	34
reduced χ²	6.71
Rwp	4.87 %
Rwp, d20	4.87 %

Fitted parameters

#	datablock	category	entry	parameter	units	start	value	s.u.	change
1	cosio	cell		length_a	Å	10.3073	10.3152	0.0004	0.1% ↑
2	cosio	cell		length_b	Å	6.00184	6.0063	0.0003	0.1% ↑
3	cosio	cell		length_c	Å	4.78713	4.79084	0.00017	0.1% ↑
4	cosio	atom_site	Co2	fract_x		0.278802	0.2786	0.0007	0.1% ↓
5	cosio	atom_site	Co2	fract_z		0.978525	0.9824	0.0018	0.4% ↑
6	cosio	atom_site	Si	fract_x		0.0916856	0.0941	0.0005	2.6% ↑
7	cosio	atom_site	Si	fract_z		0.427898	0.4285	0.0010	0.1% ↑
8	cosio	atom_site	O1	fract_x		0.0883259	0.0898	0.0004	1.7% ↑
9	cosio	atom_site	O1	fract_z		0.777472	0.7720	0.0008	0.7% ↓
10	cosio	atom_site	O2	fract_x		0.448046	0.4481	0.0004
11	cosio	atom_site	O2	fract_z		0.218994	0.2155	0.0009	1.6% ↓
12	cosio	atom_site	O3	fract_x		0.162804	0.1636	0.0003	0.5% ↑
13	cosio	atom_site	O3	fract_y		0.0313481	0.0319	0.0004	1.8% ↑
14	cosio	atom_site	O3	fract_z		0.280985	0.2798	0.0006	0.4% ↓
15	cosio	atom_site_moment	Co1	crystalaxis_x	μB	0	0.99	0.05
16	cosio	atom_site_moment	Co1	crystalaxis_y	μB	1	3.09	0.03	209.0% ↑
17	cosio	atom_site_moment	Co1	crystalaxis_z	μB	0	0.017	1.1
18	cosio	atom_site_moment	Co2	crystalaxis_y	μB	1	2.74	0.04	174.2% ↑
19	d20	peak		broad_gauss_u	deg²	0.216032	0.202	0.008	6.4% ↓
20	d20	peak		broad_gauss_v	deg²	-0.439779	-0.402	0.016	8.5% ↑
21	d20	peak		broad_gauss_w	deg²	0.321247	0.304	0.009	5.4% ↓
22	d20	peak		broad_lorentz_y	deg	0.0309051	0.012	0.005	62.5% ↓
23	d20	peak		asym_fcj_1		0.0132913	0.0626	0.0009	371.2% ↑
24	d20	instrument		calib_twotheta_offset	deg	0.295564	0.391	0.004	32.4% ↑
25	d20	linked_structure	cosio	scale		1.97998	1.783	0.014	10.0% ↓
26	d20	background	1	intensity		613.817	620	30	1.0% ↑
27	d20	background	2	intensity		593.216	584	17	1.6% ↓
28	d20	background	3	intensity		534.172	567	15	6.2% ↑
29	d20	background	4	intensity		643.098	528	9	17.9% ↓
30	d20	background	5	intensity		528.835	425	7	19.7% ↓
31	d20	background	6	intensity		404.385	426	14	5.2% ↑
32	d20	background	7	intensity		418.905	420	10	0.4% ↑
33	d20	background	8	intensity		421.726	411	5	2.7% ↓
34	d20	background	9	intensity		457.801	380	5	17.0% ↓
35	d20	background	10	intensity		379.875	370	3	2.5% ↓
36	d20	background	11	intensity		419.236	408	3	2.7% ↓
37	d20	background	12	intensity		412.057	408	3	1.0% ↓
38	d20	background	13	intensity		391.672	399	3	1.8% ↑
39	d20	background	14	intensity		339.437	345	3	1.7% ↑
40	d20	background	15	intensity		275.036	279	3	1.5% ↑
41	d20	background	16	intensity		224.586	237	4	5.4% ↑

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