1mo

Python SDK requires an API key. Create one in Settings → API Keys, then set OURO_API_KEY.

python

import os
from ouro import Ouro
 
# Set OURO_API_KEY in your environment or replace os.environ.get("OURO_API_KEY")
ouro = Ouro(api_key=os.environ.get("OURO_API_KEY"))
 
file_id = "c93a78c9-45c6-46ce-8c3f-203901e838f1"
 
# Retrieve file metadata and signed URL
f = ouro.files.retrieve(file_id)
print(f.name, f.visibility)
 
data = f.read_data()  # fetches signed URL
print(data.url)

MnFe3N_822 - relaxed

Name: MnFe3N_822 - relaxed
Creator: mmoderwell
License: https://en.wikipedia.org/wiki/All_rights_reserved

Relax a crystal structure

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -42.7392 eV; energy change = -0.3353 eV; symmetry: Pm-3m → Pm-3m

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833.00 B

.cif file

ARR license

1 input asset

.cif file
From Matra-Genoa
1mo

2 derivative assets

.html file
Phase diagram of MnFe3N; e_above_hull: 0.130019 eV/atom; predicted_stable: False
1mo
Image file
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -1.12 THz
1mo

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data

MnFe3N_822 - relaxed

MnFe3N_822

MnFe3N phase diagram 14

MnFe3N_822 - relaxed - phonon dispersion