Direct Air Capture¶

Direct Air Capture CO₂ Isotherm Predictor using ALIGNN pretrained on hMOF data. Uses alignn.pretrained.get_figshare_model to auto-download the model.

Open App

Overview¶

Direct Air Capture CO₂ Isotherm Predictor using ALIGNN pretrained on hMOF data. Uses alignn.pretrained.get_figshare_model to auto-download the model.

Data Source

ALIGNN hMOF model

Endpoints¶

GET /dac
POST /dac/predict

Request Models: DACPredictRequest

Authentication

All POST endpoints require Authorization: Bearer YOUR_TOKEN.

API Example¶

import requests

response = requests.post(
    "https://atomgpt.org/dac/predict",
    headers={
        "Authorization": "Bearer sk-XYZ",
        "accept": "application/json",
        "Content-Type": "application/json",
    },
    json={"jid": "JVASP-1002"},
)
data = response.json()
print(data)

AGAPI Agent¶

from agapi.agents import AGAPIAgent
import os

agent = AGAPIAgent(api_key=os.environ.get("AGAPI_KEY"))
response = agent.query_sync("Show direct air capture for Silicon")
print(response)

Reference¶

Comp. Mat. Sci. 259, 114063 (2025)