sisl (conda): sisl is a tool to manipulate density functional theory code input and/or output. It also implements tight-binding tools to create and manipulate multi-orbital (non)-orthogonal basis sets.
Keywords: bigdft|condensed-matter|density-functional-theory|dft|geometry|graphene|gulp|negf|physics|siesta|solid-state|solid-state-physics|tbtrans|tight-binding|transiesta|vasp|wannier90