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Gd relaxed with Prophet

Name: Gd relaxed with Prophet
Creator: mmoderwell
Published: 2026-09-24T16:55:15.315052+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

Version of · via Relax a structure and return a magCIF with ground-state moments

Gd (P6_3/mmc)

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Structure

Formula: Gd
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 2
Lattice a, b, c: 3.568 Å3.568 Å5.910 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 65.17 Å³
Density: 8.01 g/cm³

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Estimate the Curie temperature from Prophet-Spin exchange, Success

Structure

Formula: Gd
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 2
Lattice a, b, c: 3.568 Å3.568 Å5.910 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 65.17 Å³
Density: 8.01 g/cm³

Properties

Curie temperature

Attribution

ARR license

Gd relaxed with Prophet-OAME-MBD, with antiferromagnetic local moments from Prophet-Spin (Ms = 2.450 T) in the _atom_site_moment loop.

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Size: 964 B
Type: .cif file
Downloads: 0

Properties

Curie temperature

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Actions

Estimate the Curie temperature from Prophet-Spin exchange, Success

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Overview

Gd relaxed with Prophet

Overview

Structure

Attribution

Actions

Structure

Properties

Curie temperature

Attribution

Stats

Properties

Curie temperature

Actions

Data

Data