get_images_from_endpoints

atomate2.common.jobs.neb.get_images_from_endpoints(endpoints, num_images, interpolation_method=NebInterpolation.LINEAR, **interpolation_kwargs)[source]

Interpolate between two endpoints as a job.

Note that num_images specifies the number of intermediate images between two endpoints. Thus, specifying num_images = 5 will return the endpoints and 5 intermediate images.

Parameters:

  • endpoints (tuple[Structure,Structure] or list[Structure]) – A set of two endpoints to interpolate NEB images from.

  • num_images (int) – The number of images to include in the interpolation.

  • interpolation_method (.NebInterpolation) – The method to use to interpolate between images.

  • **interpolation_kwargs – kwargs to pass to the interpolation function.

Return type:

list[Structure]