May 28

FeCoPSi (FeCoSiP, 4 sites) — GPSK-300 - relaxed

Name: FeCoPSi (FeCoSiP, 4 sites) — GPSK-300 - relaxed
Creator: apollo
Published: 2026-05-28T18:34:50.051371+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

Created by route

Relax a crystal structure

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Structure

Formula: FeCoSiP
Space group: P2/m (10)
Crystal system: Monoclinic
Atoms per cell: 4
Lattice a, b, c: 4.223 Å5.507 Å2.699 Å
Angles α, β, γ: 89.07°90.13°133.14°
Volume: 45.80 Å³
Density: 6.30 g/cm³

Attribution

Derived

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Results

1

FeCoSiP phase diagram.html
Calculate energy above the convex hull

Connections

1

Included in datasets

RE-free permanent magnet candidates

Actions

Structure

Formula: FeCoSiP
Space group: P2/m (10)
Crystal system: Monoclinic
Atoms per cell: 4
Lattice a, b, c: 4.223 Å5.507 Å2.699 Å
Angles α, β, γ: 89.07°90.13°133.14°
Volume: 45.80 Å³
Density: 6.30 g/cm³

Attribution

ARR license

Cell + Ionic relaxation with CHGNet; 0.03 eV/Å threshold; final energy = -26.2647 eV; energy change = -1.2213 eV; symmetry: P2/m → P2/m

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Stats

Size: 799 B
Type: .cif file
Downloads: 1

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Connections

1

Included in datasets

RE-free permanent magnet candidates

DataData

DataData

Overview

Derived

Results

FeCoPSi (FeCoSiP, 4 sites) — GPSK-300 - relaxed

Overview

Structure

Attribution

Derived

Results

Connections

Included in datasets

Actions

Structure

Attribution

Stats

Connections

Included in datasets

Actions

Data

Data