Overview: Rh₂Li₄

Magnetic	No
Band gap (PBE)	0.000
Number of layers	2
Bilayer ID	RhLi2-be44554cce47-2-1_0_0_1-0_0
Distance [Å]	2.762
Layer group	p-6m2
Space group number	187
Slide Stability	None
Binding Energy (gs) [meV/Å2]	93.618
Layer group number	78
Space group	P-6m2
Monolayer ID	RhLi2-be44554cce47

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	28.620	No

Lengths [Å]	2.794	2.794	28.620
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

Band structure and DOS

Key values [eV]

Miscellaneous

Miscellaneous details
Unique ID	RhLi2-be44554cce47-2-1_0_0_1-0_0
Number of atoms	6
Number of species	2
Formula	Rh2Li4
Reduced formula	RhLi2
Stoichiometry	AB2
Unit cell area [Å2]	6.763
evac	3.591
folder	/home/niflheim2/cmr/WIP/stacking/tree-asbjorn/tree/AB2/RhLi2/RhLi2-be44554cce47/Li2Rh-2-1_0_0_1-0_0
Monolayer ID	RhLi2-be44554cce47
Bilayer ID	RhLi2-be44554cce47-2-1_0_0_1-0_0
Number of layers	2
Layer group number	78
Layer group	p-6m2
Space group number	187

Miscellaneous details
Space group	P-6m2
equivalent_atoms	[0 1 2 0 2 1]
has_inversion_symmetry	No
Magnetic	No
Band gap (PBE)	0.000
gap_pbe_dir	0.000
gap_pbe_nosoc	0.000
gap_pbe_dir_nosoc	0.000
dipz	-0.000
with_props	No
Slide Stability	None
Binding energy (zscan)	94.291
Binding Energy (gs) [meV/Å2]	93.618
Distance [Å]	2.762