Overview: RhLi₂

Magnetic	No
Band gap (PBE)	0.000
Dynamically stable	Yes
Number of layers	1
Energy above convex hull [eV/atom]	0.157
Layer group	p-6m2
Space group number	187
Layer group number	78
Space group	P-6m2

Repeat: 1234   Download: XYZ CIF JSON

Axis	x [Å]	y [Å]	z [Å]	Periodic
1	2.794	-0.000	0.000	Yes
2	-1.397	2.420	0.000	Yes
3	0.000	0.000	18.688	No

Lengths [Å]	2.794	2.794	18.688
Angles [°]	90.000	90.000	120.000

Stackings

Stacking	Binding energy [meV/Å2]	Slide Stability
1RhLi2-1-2--1_0_0_-1-Iz-0.33_-0.33	93.612	None
1RhLi2-1-2-1_0_0_1-0_0	93.618	None
1RhLi2-1-2--1_0_0_-1-Iz-0_0	99.278	Stable
1RhLi2-1-2-1_0_0_1--0.67_-0.33	99.433	Stable
1RhLi2-1-2--1_0_0_-1-Iz--0.33_-0.67	99.604	Stable

Miscellaneous

Miscellaneous details
Unique ID	RhLi2-be44554cce47
Number of atoms	3
Number of species	2
Formula	RhLi2
Reduced formula	RhLi2
Stoichiometry	AB2
Unit cell area [Å2]	6.763
evac	2.837
folder	/home/niflheim2/cmr/WIP/stacking/tree-asbjorn/tree/AB2/RhLi2/RhLi2-be44554cce47
Monolayer ID	RhLi2-be44554cce47
Number of layers	1
Layer group number	78
Layer group	p-6m2

Miscellaneous details
Space group number	187
Space group	P-6m2
equivalent_atoms	[0 1 1]
has_inversion_symmetry	No
Magnetic	No
Energy above convex hull [eV/atom]	0.157
Dynamically stable	Yes
Band gap (PBE)	0.000
gap_pbe_dir	0.000
gap_pbe_nosoc	0.000
gap_pbe_dir_nosoc	0.000
dipz	0.000