ase — Easy Playground

Atomic Simulation Environment: build, run, analyze atomic simulations

Getting started with aseRun locally

Install

pip install ase

Python CodeRun locally

# Install: pip install ase
import ase

# Basic ase usage
print(f"Using ase")
# See documentation for detailed examples

# Install: pip install ase
import ase

# Basic ase usage
print(f"Using ase")
# See documentation for detailed examples

Expected Output

# Expected output shown below
# (Run locally with: ase)

ase is a third-party package. Atomic Simulation Environment: build, run, analyze atomic simulations. Install with: pip install ase

Try modifying the code above to explore different behaviors. Can you extend the example to handle a new use case?