PySCF-NAO: An efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitals
| Main Author: | Ballantyne, John |
|---|---|
| Other Authors: | Koval, Peter, Barbry, Marc, Sánchez-Portal, Daniel |
| Format: | Dataset |
| Terbitan: |
Mendeley
, 2018
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| Subjects: | |
| Online Access: |
https:/data.mendeley.com/datasets/9wgp6255hn |