External reference

GPAW reference

class gpaw.GPAW

GPAW ground state calculator.

See https://gpaw.readthedocs.io/documentation/basic.html.

class gpaw.mpi.Communicator

MPI Communicator as implemented in GPAW.

See https://gpaw.readthedocs.io/devel/communicators.html.

class gpaw.lcaotddft.ksdecomposition.KohnShamDecomposition

Object that holds the Kohn-Sham decomposition, including dipole operator in electron-hole basis and electron-hole occupation number and energy differences.

See https://gpaw.readthedocs.io/tutorialsexercises/opticalresponse/tddft/lcaotddft.html.