Sep 22

CrO2 benchmark

Name: CrO2 benchmark
Creator: mmoderwell
Published: 2026-09-22T22:59:56.679+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

33

Attribution

Connections

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Derived assets

Cr2O4 relaxed with Prophet
.cif
-OAME-MBD, with ferrimagnetic local moments from Prophet-Spin (Ms = 1.171 T) in the atomsite_moment loop.

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Recent runs

Estimate the Curie temperature from Prophet-Spin exchangesuccess
Estimate the Curie temperature from Prophet-Spin exchangesuccess

Attribution

ARR license

Experimental rutile CrO2 (P4_2/mnm), a = 4.421 Å, c = 2.917 Å, O 4f x = 0.303.

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Size: 1.08 KB
Type: .cif file
Downloads: 0

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44

Connections

1

Derived assets

Cr2O4 relaxed with Prophet
.cif
-OAME-MBD, with ferrimagnetic local moments from Prophet-Spin (Ms = 1.171 T) in the atomsite_moment loop.

ActionsTools that work with this file

Available for this file

Recent runs

Estimate the Curie temperature from Prophet-Spin exchangesuccess
Estimate the Curie temperature from Prophet-Spin exchangesuccess