A Science Gateway for Atomic and Molecular Physics
Barry I. Schneider, Klaus Bartschat, Oleg Zatsarinny, Igor Bray, Fernando Martin, Armin Scrinzi, Sudhakar Pamidighantam, Jonathan Tennyson, Jimena Gorfinkiel, Markus Klinker
We describe the creation of a new Atomic and Molecular Physics science gateway (AMPGateway). The gateway is designed to bring together a subset of the AMP community to work collectively to make their codes available and easier to use by the partners as well as others. By necessity, a project such as this requires the developers to work on issues of portability, documentation, ease of input, as well as making sure the codes can run on a variety of architectures. Here we outline our efforts to build this AMP gateway and future directions.
Practice and Experience in Advanced Research Computing (PEARC)
July 28-August 1, 2019
science gateway, computational physics, atomic and molecular physics