NdTiFe11N (oxide benchmark) - relaxed - phonon dispersion

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NdTiFe11N (oxide benchmark) - relaxed - phonon dispersion

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Overview

Stats

Dimensions: 1126 × 756
Size: 152.84 KB
Type: .png file
Downloads: 0

Attribution

Use vision capabilities to understand images

fileimage→JSON

1y

15 uses

Create variations of an existing image

fileimage→file

1y

2 uses

Generate 3D assets from a single 2D input image

fileimage→file

1y

1 use

Generate a short video from an image

fileimage→file

1y

1 use

Image-to-image generation for controlled variations of existing images or sketches

fileimage→file

1y

1 use

Convert an image to a different format

fileimage→file

6mo

Compress an image

fileimage→file

6mo

You've seen it all

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Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz

ARR license

Phonon band structure with Orb v3 conservative inf MPA (supercell [3, 3, 3], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz

ARR license

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NdTiFe11N (oxide benchmark) - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -115.9717 eV; energy change = -0.0054 eV; symmetry: Imm2 → Imm2

Referenced by

When metastable is good enough: NdTiFe11N through the full Ouro pipeline
@mmoderwell's NdTiFe11N benchmark results: relaxation, convex hull, and phonon dispersion through Ouro routes. A textbook metastable-but-synthesizable magnet candidate.

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NdTiFe11N (oxide benchmark) - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -115.9717 eV; energy change = -0.0054 eV; symmetry: Imm2 → Imm2

Referenced by

When metastable is good enough: NdTiFe11N through the full Ouro pipeline
@mmoderwell's NdTiFe11N benchmark results: relaxation, convex hull, and phonon dispersion through Ouro routes. A textbook metastable-but-synthesizable magnet candidate.

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Created by route

Calculate phonon dispersion and band structure

Created by route

Calculate phonon dispersion and band structure

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NdTiFe11N (oxide benchmark) - relaxed - phonon dispersion

NdTiFe11N (oxide benchmark) - relaxed - phonon dispersion

Overview

Stats

Attribution

Use vision capabilities to understand images

Create variations of an existing image

Generate 3D assets from a single 2D input image

Generate a short video from an image

Image-to-image generation for controlled variations of existing images or sketches

Convert an image to a different format

Compress an image

Overview

Stats

Attribution

Use vision capabilities to understand images

Create variations of an existing image

Generate 3D assets from a single 2D input image

Generate a short video from an image

Image-to-image generation for controlled variations of existing images or sketches

Convert an image to a different format

Compress an image

Connections

Inputs

Referenced by

Available for this file

Connections

Inputs

Referenced by

Available for this file