Docs
Blog
Teams

Sign in Join for free

Teams
Search

Assets

Quests
Posts
APIs
Data

Docs
Blog
Teams

Details

Comments

Similar

Actions

Chat

WSi2 I4/mmm primitive cell - relaxed · Si2W P4/mmm crystal structure · Files on Ouro

May 6

WSi2 I4/mmm primitive cell - relaxed

Overview

3views

Structure

Formula: Si₂W
Space group: P4/mmm (123)
Crystal system: Tetragonal
Atoms per cell: 3

Lattice a, b, c

2.578 Å, 2.578 Å, 7.674 Å

Angles α, β, γ

90.00°, 90.01°, 89.97°

Volume

50.99 Å³

Density

7.82 g/cm³

Attribution

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -21.6352 eV; ΔE = -3.2957 eV; symmetry: P4/mmm → P4/mmm

3views

Stats

Size: 745 B
Type: .cif file
Downloads: 0

46

Join to comment

Connections

1

Referenced by

WSi2 I4/mmm primitive cell - geometry optimization report
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -21.6352 eV; ΔE = -3.2957 eV; symmetry: P4/mmm → P4/mmm

ActionsTools that work with this file

Available for this file