Marc Barbry

Publication Activity (10 Years)

Years Active: 2019-2019
Publications (10 Years): 1

Top Topics

Sensitivity Analysis

Implementation Issues

Top Venues

Comput. Phys. Commun.

Publications

Peter Koval, Marc Barbry, Daniel Sánchez-Portal
PySCF-NAO: An efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitals. Comput. Phys. Commun. 236 (2019)