Abstract

We introduce a new basis function (the spherical gaussian) for electronic structure calculations on spheres of any dimension DD. We find \alert{general} expressions for the one- and two-electron integrals and propose an efficient computational algorithm incorporating the Cauchy-Schwarz bound. Using numerical calculations for the D=2D = 2 case, we show that spherical gaussians are more efficient than spherical harmonics when the electrons are strongly localized.

Explore this paper’s authors, topics and related work.

Building this map preview

BZPEER is loading the nearby papers, people, topics and institutions for this page.

Reviews 0

Write a reviewWrite

No reviews yet.

Discussion 0

Add a commentWrite

No comments yet.