.. _feature: Features ======== Current functions ----------------- * Basic electronic structure analysis: (projected) band structure, density of states * 2D analysis: 2D band structure, spin texture * In-plane average of electrostatic potential for work function calculation * Structure analysis: spacegroup analysis, unit cell transformation, working with cif file, and variety of structure formats (POSCAR, cif, xsf) * Read WAVECAR and visualize the (real/imaginary) periodic part of a Bloch state * Read WAVEDER/WAVEDERF to get the derivative of the orbitals with respect to k * Currently, only VASP outpus are supported (vasprun.xml, OUTCAR) Soon-to-be-released functions ----------------------------- * Connecting to Bilbao Crystallographic Server * Topological analysis * Optical adsorption coefficient Future functions ---------------- * Phonon calculation * Band structure unfolding * Set up a EOS calculation