3mo
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 = "33987b8e-750b-424e-a6c4-ef2643da230e"
# 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)Fe2NiMn (Pmm2) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -31.6444 eV; energy change = -0.0024 eV; symmetry: Pmm2 → Pmm2
Fe2NiMn (Pmm2)
.cif fileFe2NiMn (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)
3moFe2NiMn (Pmm2) - relaxed - doped B 2.0%
.cif fileInterstitially doped with B at ~2.0%; supercell [3, 3, 3]; dopant atoms = 2
3moFe2NiMn (Pmm2) - relaxed - phonon dispersion
Image filePhonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.07 THz
3moMnFe2Ni phase diagram
.html filePhase diagram of MnFe2Ni; e_above_hull: 0.066408 eV/atom; predicted_stable: False
3moMAE Testing the Treequest Search
postAfter ran the pipeline, we are left with a handful of our best candidates to continue validating. The next filter they need to pass is a decent magnetocrystalline anisotropy energy. Check out Will's
3mo
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3 derivative assets
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