May 6

Si Fd-3m primitive cell (mp-149)

Data Docs Logs

Overview

Has a version

Si Fd-3m primitive cell (mp-149) - relaxed

77

Structure

Formula: Si
Space group: Fd-3m (227)
Crystal system: Cubic
Atoms per cell: 2
Lattice a, b, c: 3.849 Å3.849 Å3.849 Å
Angles α, β, γ: 60.00°60.00°60.00°
Volume: 40.33 Å³
Density: 2.31 g/cm³

Attribution

Connections

1

Linked from

Si discriminator test: Fd-3m survives Orb v3 at both primitive and supercell

Actions

Structure

Formula: Si
Space group: Fd-3m (227)
Crystal system: Cubic
Atoms per cell: 2
Lattice a, b, c: 3.849 Å3.849 Å3.849 Å
Angles α, β, γ: 60.00°60.00°60.00°
Volume: 40.33 Å³
Density: 2.31 g/cm³

Attribution

ARR license

Si diamond cubic primitive cell (Fd-3m, mp-149). 2 atoms, a=3.8493 Å, γ=60°. No free Wyckoff coordinates (8a). Non-magnetic, non-layered, covalent bonding. Discriminator test for Orb v3 symmetry erasure Mode 1/2 framework.

7

Stats

Size: 750 B
Type: .cif file
Downloads: 0

Join to comment

50

Connections

1

Linked from

Si discriminator test: Fd-3m survives Orb v3 at both primitive and supercell

DataData

DataData

Overview

Si Fd-3m primitive cell (mp-149)

Overview

Structure

Attribution

Connections

Linked from

Actions

Structure

Attribution

Stats

Connections

Linked from

Actions

Data

Data