Pr₂NiO₄ [Fmmm] · 5C2 @ LLB

#	datablock	category	entry	parameter	units	start	value	s.u.	change
1	pr2nio4	atom_site	Pr	fract_z		0.360015	0.35974	0.00008	0.1% ↓
2	pr2nio4	atom_site	O2	fract_z		0.174395	0.17383	0.00010	0.3% ↓
3	pr2nio4	atom_site	Od	fract_x		0.0530958	0.079	0.003	49.7% ↑
4	pr2nio4	atom_site	Od	fract_y		0.0665221	0.0741	0.0019	11.4% ↑
5	pr2nio4	atom_site	Od	fract_z		0.172292	0.1735	0.0007	0.7% ↑
6	pr2nio4	atom_site	Od	adp_iso	Å²	-0.3438	2.57	0.16	848.7% ↑
7	pr2nio4	atom_site_aniso	Pr	adp_11	Å²	0	0.82	0.04
8	pr2nio4	atom_site_aniso	Pr	adp_22	Å²	0	0.83	0.03
9	pr2nio4	atom_site_aniso	Pr	adp_33	Å²	0	0.52	0.03
10	pr2nio4	atom_site_aniso	Ni	adp_11	Å²	0	0.32	0.02
11	pr2nio4	atom_site_aniso	Ni	adp_22	Å²	0	0.334	0.019
12	pr2nio4	atom_site_aniso	Ni	adp_33	Å²	0	0.938	0.018
13	pr2nio4	atom_site_aniso	O1	adp_11	Å²	0	0.58	0.03
14	pr2nio4	atom_site_aniso	O1	adp_22	Å²	0	0.59	0.03
15	pr2nio4	atom_site_aniso	O1	adp_33	Å²	0	2.57	0.04
16	pr2nio4	atom_site_aniso	O1	adp_12	Å²	0	-0.164	0.017
17	pr2nio4	atom_site_aniso	O2	adp_11	Å²	0	2.13	0.07
18	pr2nio4	atom_site_aniso	O2	adp_22	Å²	0	2.17	0.07
19	pr2nio4	atom_site_aniso	O2	adp_33	Å²	0	0.30	0.04
20	pr2nio4	atom_site_aniso	Oi	adp_11	Å²	0	1.3	0.4
21	pr2nio4	atom_site_aniso	Oi	adp_22	Å²	0	1.4	0.4
22	pr2nio4	atom_site_aniso	Oi	adp_33	Å²	0	0.6	0.3
23	llb_5c2	linked_structure	pr2nio4	scale		1.88711	4.02	0.03	113.1% ↑