Force Field DB¶

JARVIS Force-Field (FF) database search. Search by elements, JID, formula, crystal system, or force-field type (EAM, Tersoff, ReaxFF, etc.).

Open App

Overview¶

JARVIS Force-Field (FF) database search. Search by elements, JID, formula, crystal system, or force-field type (EAM, Tersoff, ReaxFF, etc.).

Data Source

JARVIS-FF

Endpoints¶

GET /ff
POST /ff/search

Request Models: FFSearchRequest

Authentication

All POST endpoints require Authorization: Bearer YOUR_TOKEN.

API Example¶

import requests

response = requests.post(
    "https://atomgpt.org/ff/search",
    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 force field db for Silicon")
print(response)

Reference¶

J. Phys. Cond. Matt. 30, 395901 (2018)