Units ===== Ramannoodle uses the following units: +--------------------------+---------------+ | Quantity | Units | +==========================+===============+ | Wavenumbers | cm\ :sup:`-1` | +--------------------------+---------------+ | Intensities | Unitless | +--------------------------+---------------+ | Fractional coordinates | Unitless | +--------------------------+---------------+ | Cartesian coordinates | Å | +--------------------------+---------------+ | Polarizability\ :sup:`1` | Unitless | +--------------------------+---------------+ | Temperature | K | +--------------------------+---------------+ | Wavelength | nm | +--------------------------+---------------+ | Time | fs | +--------------------------+---------------+ \ :sup:`1` Dielectric tensor is used. By default, Ramannoodle works with positions, displacements, and directions in fractional coordinates. Some parameters are expressed in Cartesian coordinates; these parameters always have the prefix ``cart_`` appended: .. code-block:: python some_function(..., positions, ...) # positions is in fractional coordinates some_other_function(..., cart_positions, ...) # cart_positions is in Cartesian coordinates