GAMGI Formats: Atom Create

# Atom Create

- Type
- Property
- Analysis
- Position
- View

### temperature

Set the atom temperature (X-Ray Debye-Waller factor), in Angstrom squared: 0 < T < 100. Generally, T < 30 signifies confidence in its position, while T > 60 signifies disorder.

    Example: <atom ... temperature="0.0"/> (default)
    (defined in GAMGI_CHEM_ATOM_TEMPERATURE)
    Allowed values: 0.0 - 100.0 real (optional)

### occupancy

The degree of atom occupancy of a given position, as measured by X-ray diffraction.

    Example: <atom ... occupancy="1.0"/> (default)
    Allowed values: 0.0 - 1.0 real (optional)

Home