CeO₂ [Fm-3m] · PEARL @ ISIS

#	datablock	category	entry	parameter	units	start	value	s.u.	change
1	ceo2	atom_site	Ce	adp_iso	Å²	0.302	0.302	0.013	0.3%
2	ceo2	atom_site	O	adp_iso	Å²	0.495	0.496	0.011	0.2%
3	pearl	peak		rise_alpha_1		0.25542	0.25	0.04	0.2%
4	pearl	peak		decay_beta_0		0.02546	0.0255	3×10⁻⁴
5	pearl	peak		decay_beta_1		0.029035	0.0290	6×10⁻⁴	0.1%
6	pearl	peak		broad_gauss_sigma_1	µs²/Å²	83.748	84	4	0.1%
7	pearl	peak		broad_gauss_sigma_2	µs²/Å⁴	3.5618	3.6	0.6	0.1%
8	pearl	peak		broad_lorentz_gamma_1	µs/Å	4.915	4.9	0.3	0.1%
9	pearl	instrument		calib_d_to_tof_offset	µs	3.05275	3.1	0.3
10	pearl	instrument		calib_d_to_tof_linear	µs/Å	4.68×10³	4.6779×10³	0.0006×10³
11	pearl	instrument		calib_d_to_tof_quadratic	µs/Å²	1.7584	1.76	0.16	0.2%
12	pearl	linked_structure	ceo2	scale		2.11×10³	2.12×10³	0.03×10³	0.2%
13	pearl	absorption		abscor1	Å⁻¹	0.0000	3×10⁻⁴	30×10⁻⁴
14	pearl	background	1	coef		2.17×10³	2.172×10³	0.008×10³
15	pearl	background	2	coef		211.49	210	30	0.3%
16	pearl	background	3	coef		394.05	390	70	0.1%
17	pearl	background	4	coef		-1.92×10³	-1.92×10³	0.06×10³	0.1%
18	pearl	background	5	coef		1.95×10³	1.96×10³	0.12×10³	0.1%
19	pearl	background	6	coef		-587.2	-590	70	0.2%

startthe value before the fit
valuethe fitted value, where the least-squares fit ends: the weighted sum of squared residuals is smallest
s.u.its standard uncertainty, the square root of its diagonal element of the fit's covariance matrix
changehow far the fit moved it, in % of the start: up, down
s.u.in red: a poorly determined or strongly correlated parameter; its title says why